Browse entries in the PDBbind-CN Database
HEADER 4YYL_COMPLEX COMPND 4YYL_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 181 GLY PRO LEU GLY SER MET GLU ASP PHE VAL ARG GLN CYS SEQRES 2 A 181 PHE ASN PRO MET ILE VAL GLU LEU ALA GLU LYS THR MET SEQRES 3 A 181 LYS GLU TYR GLY GLU ASP LEU LYS ILE GLU THR ASN LYS SEQRES 4 A 181 PHE ALA ALA ILE CYS THR HIS LEU GLU VAL CYS PHE MET SEQRES 5 A 181 TYR SER ASP ALA SER LYS HIS ARG PHE GLU ILE ILE GLU SEQRES 6 A 181 GLY ARG ASP ARG THR MET ALA TRP THR VAL VAL ASN SER SEQRES 7 A 181 ILE CYS ASN THR THR GLY ALA GLU LYS PRO LYS PHE LEU SEQRES 8 A 181 PRO ASP LEU TYR ASP TYR LYS GLU ASN ARG PHE ILE GLU SEQRES 9 A 181 ILE GLY VAL THR ARG ARG GLU VAL HIS ILE TYR TYR LEU SEQRES 10 A 181 GLU LYS ALA ASN LYS ILE LYS SER GLU LYS THR HIS ILE SEQRES 11 A 181 HIS ILE PHE SER PHE THR GLY GLU GLU MET ALA THR LYS SEQRES 12 A 181 ALA ASP TYR THR LEU ASP GLU GLU SER ARG ALA ARG ILE SEQRES 13 A 181 LYS THR ARG LEU PHE THR ILE ARG GLN GLU MET ALA SER SEQRES 14 A 181 ARG GLY LEU TRP ASP SER PHE ARG GLN SER GLU ARG HET MN A 1 1 HET MN A 2 1 HET UNN A 354 31 ATOM 1 N GLY A -4 2.395 6.842 19.265 1.00 69.23 N ATOM 2 CA GLY A -4 1.862 6.446 17.969 1.00 70.42 C ATOM 3 C GLY A -4 0.804 7.416 17.463 1.00 67.53 C ATOM 4 O GLY A -4 0.171 8.130 18.258 1.00 58.58 O ATOM 5 HN3 GLY A -4 1.623 6.872 19.961 1.00 0.00 H ATOM 6 HN2 GLY A -4 2.830 7.784 19.187 1.00 0.00 H ATOM 7 HN1 GLY A -4 3.112 6.152 19.569 1.00 0.00 H ATOM 8 N PRO A -3 0.604 7.462 16.136 1.00 54.78 N ATOM 9 CA PRO A -3 -0.424 8.384 15.620 1.00 42.34 C ATOM 10 C PRO A -3 -1.818 7.891 16.020 1.00 49.51 C ATOM 11 O PRO A -3 -2.057 6.694 16.189 1.00 49.54 O ATOM 12 CB PRO A -3 -0.225 8.340 14.101 1.00 48.67 C ATOM 13 CG PRO A -3 0.466 7.013 13.827 1.00 49.19 C ATOM 14 CD PRO A -3 1.281 6.697 15.072 1.00 55.41 C ATOM 15 N LEU A -2 -2.734 8.821 16.218 1.00 38.47 N ATOM 16 CA LEU A -2 -4.088 8.458 16.534 1.00 32.35 C ATOM 17 C LEU A -2 -4.875 8.871 15.326 1.00 40.42 C ATOM 18 O LEU A -2 -4.902 10.056 14.981 1.00 39.08 O ATOM 19 CB LEU A -2 -4.521 9.210 17.779 1.00 40.54 C ATOM 20 CG LEU A -2 -5.508 8.471 18.664 1.00 50.47 C ATOM 21 CD1 LEU A -2 -5.487 9.006 20.054 1.00 41.85 C ATOM 22 CD2 LEU A -2 -6.896 8.615 18.102 1.00 42.53 C ATOM 23 H LEU A -2 -2.473 9.825 16.145 1.00 0.00 H ATOM 24 N GLY A -1 -5.483 7.913 14.631 1.00 38.02 N ATOM 25 CA GLY A -1 -6.131 8.221 13.345 1.00 35.40 C ATOM 26 C GLY A -1 -7.500 8.882 13.501 1.00 38.07 C ATOM 27 O GLY A -1 -8.009 9.103 14.620 1.00 37.98 O ATOM 28 H GLY A -1 -5.501 6.940 14.998 1.00 0.00 H ATOM 29 N SER A 0 -8.110 9.212 12.379 1.00 36.59 N ATOM 30 CA SER A 0 -9.487 9.709 12.409 1.00 38.52 C ATOM 31 C SER A 0 -10.489 8.554 12.246 1.00 29.68 C ATOM 32 O SER A 0 -10.339 7.741 11.344 1.00 35.30 O ATOM 33 CB SER A 0 -9.660 10.686 11.253 1.00 36.38 C ATOM 34 OG SER A 0 -10.994 10.733 10.764 1.00 41.89 O ATOM 35 HG SER A 0 -11.602 11.016 11.493 1.00 0.00 H ATOM 36 H SER A 0 -7.612 9.119 11.471 1.00 0.00 H ATOM 37 N MET A 1 -11.530 8.489 13.068 1.00 34.31 N ATOM 38 CA MET A 1 -12.522 7.419 12.876 1.00 36.12 C ATOM 39 C MET A 1 -13.288 7.539 11.544 1.00 41.48 C ATOM 40 O MET A 1 -13.547 6.541 10.850 1.00 34.84 O ATOM 41 CB MET A 1 -13.475 7.367 14.073 1.00 27.87 C ATOM 42 CG MET A 1 -14.595 6.353 13.975 1.00 29.86 C ATOM 43 SD MET A 1 -13.942 4.591 13.854 1.00 34.11 S ATOM 44 CE MET A 1 -13.851 4.201 15.571 1.00 30.88 C ATOM 45 H MET A 1 -11.642 9.183 13.835 1.00 0.00 H ATOM 46 N GLU A 2 -13.622 8.762 11.136 1.00 38.05 N ATOM 47 CA GLU A 2 -14.333 8.912 9.868 1.00 39.23 C ATOM 48 C GLU A 2 -13.486 8.391 8.696 1.00 36.51 C ATOM 49 O GLU A 2 -14.001 7.706 7.797 1.00 41.38 O ATOM 50 CB GLU A 2 -14.768 10.372 9.643 1.00 43.34 C ATOM 51 CG GLU A 2 -15.235 10.611 8.196 1.00 44.25 C ATOM 52 CD GLU A 2 -15.979 11.953 7.994 1.00 50.20 C ATOM 53 OE1 GLU A 2 -16.059 12.751 8.964 1.00 46.41 O ATOM 54 OE2 GLU A 2 -16.497 12.168 6.861 1.00 44.57 O ATOM 55 H GLU A 2 -13.381 9.595 11.710 1.00 0.00 H ATOM 56 N ASP A 3 -12.183 8.662 8.747 1.00 42.14 N ATOM 57 CA ASP A 3 -11.252 8.159 7.744 1.00 37.66 C ATOM 58 C ASP A 3 -11.306 6.621 7.760 1.00 41.43 C ATOM 59 O ASP A 3 -11.371 5.974 6.700 1.00 41.79 O ATOM 60 CB ASP A 3 -9.805 8.572 8.058 1.00 45.17 C ATOM 61 CG ASP A 3 -9.475 10.047 7.687 1.00 62.92 C ATOM 62 OD1 ASP A 3 -10.326 10.766 7.105 1.00 45.77 O ATOM 63 OD2 ASP A 3 -8.313 10.464 7.960 1.00 52.48 O ATOM 64 H ASP A 3 -11.819 9.249 9.524 1.00 0.00 H ATOM 65 N PHE A 4 -11.243 6.046 8.964 1.00 35.28 N ATOM 66 CA PHE A 4 -11.279 4.583 9.088 1.00 34.92 C ATOM 67 C PHE A 4 -12.523 4.025 8.439 1.00 32.52 C ATOM 68 O PHE A 4 -12.438 3.090 7.650 1.00 34.72 O ATOM 69 CB PHE A 4 -11.190 4.094 10.554 1.00 37.93 C ATOM 70 CG PHE A 4 -11.519 2.622 10.711 1.00 39.46 C ATOM 71 CD1 PHE A 4 -10.647 1.642 10.212 1.00 41.48 C ATOM 72 CD2 PHE A 4 -12.716 2.216 11.269 1.00 34.82 C ATOM 73 CE1 PHE A 4 -10.980 0.269 10.310 1.00 38.27 C ATOM 74 CE2 PHE A 4 -13.041 0.844 11.402 1.00 38.60 C ATOM 75 CZ PHE A 4 -12.179 -0.119 10.923 1.00 37.06 C ATOM 76 H PHE A 4 -11.168 6.637 9.817 1.00 0.00 H ATOM 77 N VAL A 5 -13.677 4.606 8.746 1.00 33.63 N ATOM 78 CA VAL A 5 -14.943 4.067 8.256 1.00 37.90 C ATOM 79 C VAL A 5 -15.017 4.162 6.731 1.00 46.45 C ATOM 80 O VAL A 5 -15.440 3.205 6.045 1.00 38.70 O ATOM 81 CB VAL A 5 -16.143 4.839 8.879 1.00 39.07 C ATOM 82 CG1 VAL A 5 -17.480 4.489 8.168 1.00 35.46 C ATOM 83 CG2 VAL A 5 -16.220 4.616 10.399 1.00 34.44 C ATOM 84 H VAL A 5 -13.679 5.457 9.344 1.00 0.00 H ATOM 85 N ARG A 6 -14.609 5.315 6.191 1.00 36.66 N ATOM 86 CA ARG A 6 -14.705 5.504 4.747 1.00 43.80 C ATOM 87 C ARG A 6 -13.724 4.618 3.999 1.00 43.15 C ATOM 88 O ARG A 6 -14.002 4.162 2.883 1.00 43.50 O ATOM 89 CB ARG A 6 -14.542 6.986 4.382 1.00 45.02 C ATOM 90 CG ARG A 6 -15.745 7.832 4.854 1.00 39.92 C ATOM 91 CD ARG A 6 -15.742 9.280 4.289 1.00 40.57 C ATOM 92 NE ARG A 6 -16.717 10.080 5.019 1.00 45.20 N ATOM 93 CZ ARG A 6 -18.022 10.064 4.753 1.00 46.55 C ATOM 94 NH1 ARG A 6 -18.485 9.300 3.768 1.00 42.93 N ATOM 95 NH2 ARG A 6 -18.864 10.804 5.462 1.00 45.99 N ATOM 96 HE ARG A 6 -16.377 10.694 5.786 1.00 0.00 H ATOM 97 HH12 ARG A 6 -19.503 9.284 3.557 1.00 0.00 H ATOM 98 HH11 ARG A 6 -17.829 8.718 3.209 1.00 0.00 H ATOM 99 HH22 ARG A 6 -19.881 10.785 5.247 1.00 0.00 H ATOM 100 HH21 ARG A 6 -18.507 11.403 6.233 1.00 0.00 H ATOM 101 H ARG A 6 -14.227 6.071 6.795 1.00 0.00 H ATOM 102 N GLN A 7 -12.589 4.321 4.615 1.00 43.39 N ATOM 103 CA GLN A 7 -11.649 3.402 3.975 1.00 42.26 C ATOM 104 C GLN A 7 -11.976 1.915 4.147 1.00 48.52 C ATOM 105 O GLN A 7 -11.726 1.137 3.238 1.00 53.44 O ATOM 106 CB GLN A 7 -10.214 3.684 4.455 1.00 46.47 C ATOM 107 CG GLN A 7 -9.715 5.088 4.081 1.00 66.36 C ATOM 108 CD GLN A 7 -8.723 5.687 5.090 1.00 73.87 C ATOM 109 OE1 GLN A 7 -8.122 4.981 5.920 1.00 60.77 O ATOM 110 NE2 GLN A 7 -8.555 7.008 5.018 1.00 65.61 N ATOM 111 HE22 GLN A 7 -9.077 7.561 4.309 1.00 0.00 H ATOM 112 HE21 GLN A 7 -7.902 7.485 5.671 1.00 0.00 H ATOM 113 H GLN A 7 -12.369 4.737 5.543 1.00 0.00 H ATOM 114 N CYS A 8 -12.543 1.506 5.276 1.00 42.77 N ATOM 115 CA CYS A 8 -12.655 0.074 5.543 1.00 39.95 C ATOM 116 C CYS A 8 -14.048 -0.538 5.441 1.00 47.11 C ATOM 117 O CYS A 8 -14.195 -1.756 5.587 1.00 43.12 O ATOM 118 CB CYS A 8 -11.949 -0.320 6.864 1.00 47.77 C ATOM 119 SG CYS A 8 -10.089 -0.372 6.759 1.00 64.11 S ATOM 120 H CYS A 8 -12.904 2.198 5.963 1.00 0.00 H ATOM 121 N PHE A 9 -15.065 0.273 5.149 1.00 37.44 N ATOM 122 CA PHE A 9 -16.390 -0.276 4.913 1.00 41.04 C ATOM 123 C PHE A 9 -16.766 -0.054 3.474 1.00 43.94 C ATOM 124 O PHE A 9 -16.411 0.946 2.880 1.00 38.58 O ATOM 125 CB PHE A 9 -17.453 0.350 5.836 1.00 37.04 C ATOM 126 CG PHE A 9 -17.395 -0.168 7.245 1.00 39.99 C ATOM 127 CD1 PHE A 9 -18.090 -1.328 7.604 1.00 32.72 C ATOM 128 CD2 PHE A 9 -16.622 0.485 8.198 1.00 35.04 C ATOM 129 CE1 PHE A 9 -18.012 -1.818 8.914 1.00 29.48 C ATOM 130 CE2 PHE A 9 -16.528 0.008 9.512 1.00 39.53 C ATOM 131 CZ PHE A 9 -17.229 -1.141 9.871 1.00 28.22 C ATOM 132 H PHE A 9 -14.910 1.300 5.090 1.00 0.00 H ATOM 133 N ASN A 10 -17.503 -0.986 2.923 1.00 42.43 N ATOM 134 CA ASN A 10 -17.964 -0.842 1.555 1.00 43.42 C ATOM 135 C ASN A 10 -18.825 0.431 1.355 1.00 38.23 C ATOM 136 O ASN A 10 -19.591 0.817 2.245 1.00 37.96 O ATOM 137 CB ASN A 10 -18.722 -2.103 1.180 1.00 50.42 C ATOM 138 CG ASN A 10 -19.973 -1.808 0.450 1.00 51.33 C ATOM 139 OD1 ASN A 10 -21.046 -1.659 1.061 1.00 62.00 O ATOM 140 ND2 ASN A 10 -19.863 -1.668 -0.862 1.00 60.68 N ATOM 141 HD22 ASN A 10 -18.941 -1.804 -1.324 1.00 0.00 H ATOM 142 HD21 ASN A 10 -20.698 -1.422 -1.431 1.00 0.00 H ATOM 143 H ASN A 10 -17.759 -1.833 3.469 1.00 0.00 H ATOM 144 N PRO A 11 -18.707 1.094 0.185 1.00 44.53 N ATOM 145 CA PRO A 11 -19.415 2.370 -0.031 1.00 44.76 C ATOM 146 C PRO A 11 -20.948 2.294 0.117 1.00 36.76 C ATOM 147 O PRO A 11 -21.564 3.268 0.549 1.00 43.94 O ATOM 148 CB PRO A 11 -19.019 2.749 -1.470 1.00 46.39 C ATOM 149 CG PRO A 11 -17.672 2.137 -1.640 1.00 46.60 C ATOM 150 CD PRO A 11 -17.719 0.825 -0.881 1.00 45.38 C ATOM 151 N MET A 12 -21.571 1.171 -0.214 1.00 42.85 N ATOM 152 CA MET A 12 -23.018 1.066 -0.040 1.00 46.52 C ATOM 153 C MET A 12 -23.390 1.125 1.451 1.00 38.96 C ATOM 154 O MET A 12 -24.372 1.763 1.846 1.00 37.04 O ATOM 155 CB MET A 12 -23.514 -0.254 -0.645 1.00 46.27 C ATOM 156 CG MET A 12 -24.988 -0.580 -0.341 1.00 56.12 C ATOM 157 SD MET A 12 -25.488 -2.287 -0.753 1.00 89.08 S ATOM 158 CE MET A 12 -24.454 -3.267 0.370 1.00 63.81 C ATOM 159 H MET A 12 -21.032 0.368 -0.596 1.00 0.00 H ATOM 160 N ILE A 13 -22.623 0.407 2.271 1.00 39.59 N ATOM 161 CA ILE A 13 -22.792 0.453 3.738 1.00 37.06 C ATOM 162 C ILE A 13 -22.619 1.885 4.267 1.00 28.76 C ATOM 163 O ILE A 13 -23.399 2.380 5.083 1.00 33.62 O ATOM 164 CB ILE A 13 -21.715 -0.417 4.446 1.00 36.93 C ATOM 165 CG1 ILE A 13 -21.870 -1.923 4.114 1.00 39.46 C ATOM 166 CG2 ILE A 13 -21.752 -0.141 6.009 1.00 31.35 C ATOM 167 CD1 ILE A 13 -23.147 -2.529 4.603 1.00 45.62 C ATOM 168 H ILE A 13 -21.884 -0.203 1.867 1.00 0.00 H ATOM 169 N VAL A 14 -21.558 2.538 3.823 1.00 34.76 N ATOM 170 CA VAL A 14 -21.283 3.891 4.302 1.00 37.01 C ATOM 171 C VAL A 14 -22.417 4.847 3.903 1.00 38.67 C ATOM 172 O VAL A 14 -22.892 5.627 4.714 1.00 36.27 O ATOM 173 CB VAL A 14 -19.984 4.373 3.741 1.00 38.31 C ATOM 174 CG1 VAL A 14 -19.780 5.864 4.086 1.00 43.08 C ATOM 175 CG2 VAL A 14 -18.804 3.491 4.270 1.00 39.11 C ATOM 176 H VAL A 14 -20.921 2.089 3.134 1.00 0.00 H ATOM 177 N GLU A 15 -22.879 4.763 2.666 1.00 41.36 N ATOM 178 CA GLU A 15 -23.984 5.647 2.227 1.00 41.30 C ATOM 179 C GLU A 15 -25.249 5.379 3.043 1.00 40.35 C ATOM 180 O GLU A 15 -25.957 6.314 3.448 1.00 40.19 O ATOM 181 CB GLU A 15 -24.261 5.430 0.715 1.00 47.53 C ATOM 182 CG GLU A 15 -25.468 6.249 0.145 1.00 57.34 C ATOM 183 CD GLU A 15 -25.903 5.793 -1.260 1.00 84.91 C ATOM 184 OE1 GLU A 15 -25.062 5.796 -2.194 1.00 82.01 O ATOM 185 OE2 GLU A 15 -27.091 5.424 -1.423 1.00 82.12 O ATOM 186 H GLU A 15 -22.467 4.077 2.002 1.00 0.00 H ATOM 187 N LEU A 16 -25.545 4.100 3.310 1.00 36.95 N ATOM 188 CA LEU A 16 -26.744 3.798 4.102 1.00 34.90 C ATOM 189 C LEU A 16 -26.584 4.327 5.500 1.00 34.07 C ATOM 190 O LEU A 16 -27.522 4.822 6.100 1.00 35.30 O ATOM 191 CB LEU A 16 -27.042 2.275 4.135 1.00 32.11 C ATOM 192 CG LEU A 16 -27.416 1.592 2.813 1.00 39.21 C ATOM 193 CD1 LEU A 16 -27.571 0.049 2.960 1.00 41.82 C ATOM 194 CD2 LEU A 16 -28.661 2.193 2.193 1.00 46.79 C ATOM 195 H LEU A 16 -24.935 3.333 2.962 1.00 0.00 H ATOM 196 N ALA A 17 -25.374 4.226 6.035 1.00 35.46 N ATOM 197 CA ALA A 17 -25.132 4.740 7.375 1.00 34.54 C ATOM 198 C ALA A 17 -25.307 6.272 7.411 1.00 38.06 C ATOM 199 O ALA A 17 -25.918 6.837 8.332 1.00 34.21 O ATOM 200 CB ALA A 17 -23.718 4.349 7.814 1.00 33.33 C ATOM 201 H ALA A 17 -24.602 3.781 5.499 1.00 0.00 H ATOM 202 N GLU A 18 -24.789 6.944 6.399 1.00 36.79 N ATOM 203 CA GLU A 18 -24.952 8.406 6.362 1.00 42.98 C ATOM 204 C GLU A 18 -26.412 8.794 6.289 1.00 43.87 C ATOM 205 O GLU A 18 -26.874 9.694 7.002 1.00 43.22 O ATOM 206 CB GLU A 18 -24.233 8.992 5.159 1.00 47.37 C ATOM 207 CG GLU A 18 -22.750 8.897 5.234 1.00 45.70 C ATOM 208 CD GLU A 18 -22.057 9.292 3.920 1.00 53.63 C ATOM 209 OE1 GLU A 18 -22.383 8.748 2.844 1.00 58.38 O ATOM 210 OE2 GLU A 18 -21.146 10.141 3.963 1.00 62.61 O ATOM 211 H GLU A 18 -24.275 6.449 5.642 1.00 0.00 H ATOM 212 N LYS A 19 -27.146 8.116 5.412 1.00 42.00 N ATOM 213 CA LYS A 19 -28.571 8.389 5.266 1.00 48.15 C ATOM 214 C LYS A 19 -29.311 8.121 6.556 1.00 38.66 C ATOM 215 O LYS A 19 -30.211 8.874 6.964 1.00 47.11 O ATOM 216 CB LYS A 19 -29.128 7.531 4.135 1.00 47.80 C ATOM 217 CG LYS A 19 -30.210 8.165 3.336 1.00 65.37 C ATOM 218 CD LYS A 19 -30.269 7.515 1.961 1.00 72.90 C ATOM 219 CE LYS A 19 -28.944 7.651 1.233 1.00 69.49 C ATOM 220 NZ LYS A 19 -29.098 7.343 -0.221 1.00 76.96 N ATOM 221 HZ1 LYS A 19 -29.442 6.368 -0.333 1.00 0.00 H ATOM 222 HZ2 LYS A 19 -29.781 8.004 -0.644 1.00 0.00 H ATOM 223 HZ3 LYS A 19 -28.178 7.444 -0.695 1.00 0.00 H ATOM 224 H LYS A 19 -26.699 7.384 4.824 1.00 0.00 H ATOM 225 N THR A 20 -28.930 7.057 7.254 1.00 37.61 N ATOM 226 CA THR A 20 -29.597 6.764 8.508 1.00 36.32 C ATOM 227 C THR A 20 -29.356 7.881 9.526 1.00 48.95 C ATOM 228 O THR A 20 -30.260 8.273 10.285 1.00 47.14 O ATOM 229 CB THR A 20 -29.084 5.457 9.106 1.00 47.34 C ATOM 230 OG1 THR A 20 -29.465 4.386 8.242 1.00 53.10 O ATOM 231 CG2 THR A 20 -29.710 5.244 10.454 1.00 46.91 C ATOM 232 HG1 THR A 20 -29.067 4.529 7.347 1.00 0.00 H ATOM 233 H THR A 20 -28.165 6.444 6.907 1.00 0.00 H ATOM 234 N MET A 21 -28.121 8.366 9.562 1.00 40.39 N ATOM 235 CA MET A 21 -27.788 9.341 10.577 1.00 36.59 C ATOM 236 C MET A 21 -28.552 10.630 10.274 1.00 44.38 C ATOM 237 O MET A 21 -29.088 11.267 11.200 1.00 44.94 O ATOM 238 CB MET A 21 -26.286 9.563 10.599 1.00 40.42 C ATOM 239 CG MET A 21 -25.560 8.405 11.265 1.00 42.94 C ATOM 240 SD MET A 21 -23.832 8.745 11.672 1.00 43.86 S ATOM 241 CE MET A 21 -24.067 9.664 13.186 1.00 38.29 C ATOM 242 H MET A 21 -27.407 8.051 8.874 1.00 0.00 H ATOM 243 N LYS A 22 -28.641 10.972 8.987 1.00 42.05 N ATOM 244 CA LYS A 22 -29.373 12.195 8.578 1.00 54.79 C ATOM 245 C LYS A 22 -30.854 12.087 8.899 1.00 55.52 C ATOM 246 O LYS A 22 -31.477 13.037 9.376 1.00 56.22 O ATOM 247 CB LYS A 22 -29.209 12.496 7.083 1.00 48.71 C ATOM 248 CG LYS A 22 -27.877 13.149 6.692 1.00 60.97 C ATOM 249 CD LYS A 22 -27.442 12.759 5.260 1.00 68.98 C ATOM 250 CE LYS A 22 -25.961 13.081 4.994 1.00 75.11 C ATOM 251 NZ LYS A 22 -25.424 12.428 3.753 1.00 77.67 N ATOM 252 HZ1 LYS A 22 -25.509 11.395 3.841 1.00 0.00 H ATOM 253 HZ2 LYS A 22 -25.968 12.753 2.929 1.00 0.00 H ATOM 254 HZ3 LYS A 22 -24.424 12.685 3.633 1.00 0.00 H ATOM 255 H LYS A 22 -28.192 10.375 8.264 1.00 0.00 H ATOM 256 N GLU A 23 -31.424 10.920 8.638 1.00 49.00 N ATOM 257 CA GLU A 23 -32.820 10.679 8.940 1.00 53.94 C ATOM 258 C GLU A 23 -33.121 10.887 10.424 1.00 55.13 C ATOM 259 O GLU A 23 -34.195 11.368 10.769 1.00 57.34 O ATOM 260 CB GLU A 23 -33.239 9.286 8.426 1.00 45.82 C ATOM 261 CG GLU A 23 -34.539 8.767 8.956 1.00 56.62 C ATOM 262 CD GLU A 23 -34.962 7.487 8.237 1.00 67.04 C ATOM 263 OE1 GLU A 23 -34.168 6.959 7.421 1.00 64.10 O ATOM 264 OE2 GLU A 23 -36.088 7.017 8.500 1.00 57.39 O ATOM 265 H GLU A 23 -30.858 10.161 8.207 1.00 0.00 H ATOM 266 N TYR A 24 -32.174 10.579 11.306 1.00 54.75 N ATOM 267 CA TYR A 24 -32.434 10.722 12.733 1.00 53.13 C ATOM 268 C TYR A 24 -31.819 11.998 13.316 1.00 59.14 C ATOM 269 O TYR A 24 -31.711 12.143 14.532 1.00 56.79 O ATOM 270 CB TYR A 24 -31.990 9.482 13.523 1.00 55.62 C ATOM 271 CG TYR A 24 -32.866 8.250 13.276 1.00 69.37 C ATOM 272 CD1 TYR A 24 -32.650 7.420 12.169 1.00 64.49 C ATOM 273 CD2 TYR A 24 -33.910 7.919 14.144 1.00 79.25 C ATOM 274 CE1 TYR A 24 -33.445 6.290 11.935 1.00 70.31 C ATOM 275 CE2 TYR A 24 -34.707 6.792 13.920 1.00 85.73 C ATOM 276 CZ TYR A 24 -34.472 5.987 12.810 1.00 80.13 C ATOM 277 OH TYR A 24 -35.264 4.881 12.589 1.00 73.47 O ATOM 278 HH TYR A 24 -34.965 4.422 11.764 1.00 0.00 H ATOM 279 H TYR A 24 -31.249 10.236 10.978 1.00 0.00 H ATOM 280 N GLY A 25 -31.421 12.918 12.439 1.00 48.60 N ATOM 281 CA GLY A 25 -31.000 14.236 12.873 1.00 60.00 C ATOM 282 C GLY A 25 -29.715 14.225 13.674 1.00 69.02 C ATOM 283 O GLY A 25 -29.688 14.680 14.825 1.00 65.47 O ATOM 284 H GLY A 25 -31.412 12.687 11.425 1.00 0.00 H ATOM 285 N GLU A 26 -28.655 13.699 13.057 1.00 66.42 N ATOM 286 CA GLU A 26 -27.347 13.565 13.706 1.00 59.94 C ATOM 287 C GLU A 26 -26.194 13.827 12.771 1.00 55.78 C ATOM 288 O GLU A 26 -26.196 13.401 11.588 1.00 50.78 O ATOM 289 CB GLU A 26 -27.164 12.172 14.263 1.00 47.86 C ATOM 290 CG GLU A 26 -28.147 11.796 15.324 1.00 57.87 C ATOM 291 CD GLU A 26 -27.917 10.383 15.775 1.00 68.70 C ATOM 292 OE1 GLU A 26 -27.674 9.528 14.893 1.00 68.63 O ATOM 293 OE2 GLU A 26 -27.957 10.131 16.997 1.00 74.03 O ATOM 294 H GLU A 26 -28.761 13.371 12.076 1.00 0.00 H ATOM 295 N ASP A 27 -25.180 14.498 13.314 1.00 47.76 N ATOM 296 CA ASP A 27 -24.009 14.822 12.522 1.00 49.16 C ATOM 297 C ASP A 27 -22.944 13.774 12.761 1.00 50.50 C ATOM 298 O ASP A 27 -22.448 13.664 13.906 1.00 44.77 O ATOM 299 CB ASP A 27 -23.444 16.200 12.901 1.00 50.03 C ATOM 300 CG ASP A 27 -22.552 16.781 11.814 1.00 53.31 C ATOM 301 OD1 ASP A 27 -22.019 16.008 10.986 1.00 58.17 O ATOM 302 OD2 ASP A 27 -22.397 18.022 11.760 1.00 74.87 O ATOM 303 H ASP A 27 -25.228 14.791 14.311 1.00 0.00 H ATOM 304 N LEU A 28 -22.567 13.066 11.684 1.00 42.61 N ATOM 305 CA LEU A 28 -21.542 12.029 11.741 1.00 51.79 C ATOM 306 C LEU A 28 -20.182 12.634 12.072 1.00 58.13 C ATOM 307 O LEU A 28 -19.225 11.906 12.345 1.00 46.15 O ATOM 308 CB LEU A 28 -21.454 11.233 10.424 1.00 44.61 C ATOM 309 CG LEU A 28 -20.947 11.911 9.157 1.00 54.02 C ATOM 310 CD1 LEU A 28 -19.417 11.831 8.995 1.00 46.38 C ATOM 311 CD2 LEU A 28 -21.620 11.335 7.946 1.00 44.64 C ATOM 312 H LEU A 28 -23.025 13.265 10.771 1.00 0.00 H ATOM 313 N LYS A 29 -20.078 13.963 12.023 1.00 59.35 N ATOM 314 CA LYS A 29 -18.802 14.601 12.349 1.00 50.88 C ATOM 315 C LYS A 29 -18.624 14.809 13.847 1.00 34.97 C ATOM 316 O LYS A 29 -17.504 14.923 14.330 1.00 51.41 O ATOM 317 CB LYS A 29 -18.573 15.864 11.487 1.00 57.17 C ATOM 318 CG LYS A 29 -18.022 15.461 10.144 1.00 48.71 C ATOM 319 CD LYS A 29 -18.066 16.527 9.107 1.00 63.56 C ATOM 320 CE LYS A 29 -19.496 16.819 8.710 1.00 74.66 C ATOM 321 NZ LYS A 29 -19.601 18.076 7.895 1.00 71.35 N ATOM 322 HZ1 LYS A 29 -19.245 18.879 8.451 1.00 0.00 H ATOM 323 HZ2 LYS A 29 -19.035 17.974 7.029 1.00 0.00 H ATOM 324 HZ3 LYS A 29 -20.596 18.242 7.642 1.00 0.00 H ATOM 325 H LYS A 29 -20.899 14.542 11.755 1.00 0.00 H ATOM 326 N ILE A 30 -19.711 14.790 14.605 1.00 43.52 N ATOM 327 CA ILE A 30 -19.623 14.852 16.067 1.00 55.40 C ATOM 328 C ILE A 30 -20.001 13.489 16.678 1.00 61.13 C ATOM 329 O ILE A 30 -19.887 13.244 17.883 1.00 53.58 O ATOM 330 CB ILE A 30 -20.494 16.025 16.633 1.00 59.56 C ATOM 331 CG1 ILE A 30 -19.709 17.333 16.579 1.00 53.18 C ATOM 332 CG2 ILE A 30 -20.950 15.820 18.068 1.00 56.12 C ATOM 333 CD1 ILE A 30 -19.273 17.692 15.188 1.00 59.76 C ATOM 334 H ILE A 30 -20.646 14.730 14.153 1.00 0.00 H ATOM 335 N GLU A 31 -20.472 12.573 15.852 1.00 42.55 N ATOM 336 CA GLU A 31 -20.839 11.300 16.443 1.00 39.76 C ATOM 337 C GLU A 31 -20.193 10.209 15.621 1.00 41.17 C ATOM 338 O GLU A 31 -20.857 9.294 15.145 1.00 32.81 O ATOM 339 CB GLU A 31 -22.365 11.162 16.514 1.00 44.01 C ATOM 340 CG GLU A 31 -23.042 12.287 17.373 1.00 45.91 C ATOM 341 CD GLU A 31 -24.409 11.881 17.917 1.00 73.27 C ATOM 342 OE1 GLU A 31 -25.301 11.552 17.098 1.00 76.29 O ATOM 343 OE2 GLU A 31 -24.591 11.881 19.164 1.00 81.11 O ATOM 344 H GLU A 31 -20.574 12.754 14.833 1.00 0.00 H ATOM 345 N THR A 32 -18.892 10.355 15.410 1.00 33.89 N ATOM 346 CA THR A 32 -18.168 9.497 14.481 1.00 35.59 C ATOM 347 C THR A 32 -18.083 8.043 15.034 1.00 31.41 C ATOM 348 O THR A 32 -18.085 7.063 14.246 1.00 35.43 O ATOM 349 CB THR A 32 -16.775 10.107 14.151 1.00 49.06 C ATOM 350 OG1 THR A 32 -16.913 11.531 13.983 1.00 53.98 O ATOM 351 CG2 THR A 32 -16.253 9.555 12.842 1.00 49.75 C ATOM 352 HG1 THR A 32 -17.542 11.715 13.241 1.00 0.00 H ATOM 353 H THR A 32 -18.376 11.100 15.920 1.00 0.00 H ATOM 354 N ASN A 33 -18.030 7.896 16.353 1.00 32.56 N ATOM 355 CA ASN A 33 -18.050 6.555 16.946 1.00 37.75 C ATOM 356 C ASN A 33 -19.376 5.867 16.645 1.00 43.11 C ATOM 357 O ASN A 33 -19.448 4.656 16.361 1.00 33.51 O ATOM 358 CB ASN A 33 -17.787 6.582 18.470 1.00 31.98 C ATOM 359 CG ASN A 33 -16.293 6.700 18.814 1.00 36.30 C ATOM 360 OD1 ASN A 33 -15.437 6.246 18.062 1.00 34.37 O ATOM 361 ND2 ASN A 33 -15.982 7.383 19.936 1.00 35.71 N ATOM 362 HD22 ASN A 33 -16.739 7.752 20.547 1.00 0.00 H ATOM 363 HD21 ASN A 33 -14.986 7.541 20.190 1.00 0.00 H ATOM 364 H ASN A 33 -17.974 8.734 16.967 1.00 0.00 H ATOM 365 N LYS A 34 -20.453 6.636 16.695 1.00 36.94 N ATOM 366 CA LYS A 34 -21.757 6.092 16.338 1.00 33.04 C ATOM 367 C LYS A 34 -21.824 5.753 14.858 1.00 31.77 C ATOM 368 O LYS A 34 -22.464 4.756 14.476 1.00 33.06 O ATOM 369 CB LYS A 34 -22.864 7.087 16.703 1.00 42.00 C ATOM 370 CG LYS A 34 -24.253 6.461 16.799 1.00 43.30 C ATOM 371 CD LYS A 34 -25.313 7.533 17.012 1.00 53.49 C ATOM 372 CE LYS A 34 -26.693 6.930 17.273 1.00 59.67 C ATOM 373 NZ LYS A 34 -27.591 7.918 17.951 1.00 62.60 N ATOM 374 HZ1 LYS A 34 -27.172 8.199 18.860 1.00 0.00 H ATOM 375 HZ2 LYS A 34 -27.702 8.756 17.346 1.00 0.00 H ATOM 376 HZ3 LYS A 34 -28.521 7.483 18.116 1.00 0.00 H ATOM 377 H LYS A 34 -20.368 7.630 16.990 1.00 0.00 H ATOM 378 N PHE A 35 -21.181 6.568 14.013 1.00 31.97 N ATOM 379 CA PHE A 35 -21.161 6.325 12.570 1.00 35.07 C ATOM 380 C PHE A 35 -20.500 4.948 12.364 1.00 35.29 C ATOM 381 O PHE A 35 -20.965 4.094 11.572 1.00 30.53 O ATOM 382 CB PHE A 35 -20.358 7.461 11.910 1.00 31.51 C ATOM 383 CG PHE A 35 -20.224 7.367 10.441 1.00 33.88 C ATOM 384 CD1 PHE A 35 -21.290 6.965 9.636 1.00 33.05 C ATOM 385 CD2 PHE A 35 -19.037 7.734 9.843 1.00 35.16 C ATOM 386 CE1 PHE A 35 -21.132 6.914 8.241 1.00 33.52 C ATOM 387 CE2 PHE A 35 -18.857 7.694 8.464 1.00 42.74 C ATOM 388 CZ PHE A 35 -19.934 7.286 7.651 1.00 38.92 C ATOM 389 H PHE A 35 -20.681 7.397 14.393 1.00 0.00 H ATOM 390 N ALA A 36 -19.430 4.709 13.120 1.00 31.97 N ATOM 391 CA ALA A 36 -18.712 3.413 12.997 1.00 32.32 C ATOM 392 C ALA A 36 -19.571 2.245 13.484 1.00 25.30 C ATOM 393 O ALA A 36 -19.582 1.148 12.879 1.00 29.82 O ATOM 394 CB ALA A 36 -17.386 3.466 13.756 1.00 31.32 C ATOM 395 H ALA A 36 -19.098 5.427 13.795 1.00 0.00 H ATOM 396 N ALA A 37 -20.280 2.440 14.583 1.00 26.96 N ATOM 397 CA ALA A 37 -21.185 1.402 15.101 1.00 31.30 C ATOM 398 C ALA A 37 -22.364 1.058 14.187 1.00 37.20 C ATOM 399 O ALA A 37 -22.757 -0.103 14.083 1.00 27.12 O ATOM 400 CB ALA A 37 -21.718 1.789 16.489 1.00 30.62 C ATOM 401 H ALA A 37 -20.196 3.344 15.091 1.00 0.00 H ATOM 402 N ILE A 38 -22.984 2.073 13.592 1.00 29.84 N ATOM 403 CA ILE A 38 -24.023 1.845 12.595 1.00 26.23 C ATOM 404 C ILE A 38 -23.484 1.065 11.384 1.00 26.12 C ATOM 405 O ILE A 38 -24.154 0.134 10.900 1.00 28.21 O ATOM 406 CB ILE A 38 -24.615 3.226 12.142 1.00 32.69 C ATOM 407 CG1 ILE A 38 -25.357 3.862 13.339 1.00 33.88 C ATOM 408 CG2 ILE A 38 -25.554 3.049 10.913 1.00 32.45 C ATOM 409 CD1 ILE A 38 -25.631 5.408 13.175 1.00 40.59 C ATOM 410 H ILE A 38 -22.723 3.048 13.843 1.00 0.00 H ATOM 411 N CYS A 39 -22.328 1.466 10.861 1.00 29.78 N ATOM 412 CA CYS A 39 -21.747 0.705 9.740 1.00 31.15 C ATOM 413 C CYS A 39 -21.458 -0.765 10.105 1.00 31.98 C ATOM 414 O CYS A 39 -21.718 -1.679 9.315 1.00 30.14 O ATOM 415 CB CYS A 39 -20.469 1.344 9.251 1.00 31.53 C ATOM 416 SG CYS A 39 -20.721 2.930 8.354 1.00 34.56 S ATOM 417 H CYS A 39 -21.841 2.304 11.238 1.00 0.00 H ATOM 418 N THR A 40 -20.864 -0.967 11.270 1.00 27.95 N ATOM 419 CA THR A 40 -20.578 -2.338 11.772 1.00 28.22 C ATOM 420 C THR A 40 -21.859 -3.153 11.858 1.00 28.60 C ATOM 421 O THR A 40 -21.948 -4.280 11.348 1.00 29.56 O ATOM 422 CB THR A 40 -19.875 -2.281 13.179 1.00 28.31 C ATOM 423 OG1 THR A 40 -18.589 -1.661 12.998 1.00 28.31 O ATOM 424 CG2 THR A 40 -19.676 -3.696 13.792 1.00 30.17 C ATOM 425 HG1 THR A 40 -18.712 -0.748 12.636 1.00 0.00 H ATOM 426 H THR A 40 -20.590 -0.147 11.849 1.00 0.00 H ATOM 427 N HIS A 41 -22.865 -2.608 12.524 1.00 26.19 N ATOM 428 CA HIS A 41 -24.137 -3.327 12.669 1.00 27.76 C ATOM 429 C HIS A 41 -24.787 -3.622 11.322 1.00 33.37 C ATOM 430 O HIS A 41 -25.277 -4.737 11.078 1.00 27.08 O ATOM 431 CB HIS A 41 -25.079 -2.514 13.557 1.00 29.33 C ATOM 432 CG HIS A 41 -26.461 -3.066 13.677 1.00 28.07 C ATOM 433 ND1 HIS A 41 -27.503 -2.656 12.869 1.00 29.00 N ATOM 434 CD2 HIS A 41 -26.995 -3.958 14.549 1.00 30.79 C ATOM 435 CE1 HIS A 41 -28.611 -3.279 13.224 1.00 32.32 C ATOM 436 NE2 HIS A 41 -28.331 -4.071 14.246 1.00 34.17 N ATOM 437 H HIS A 41 -22.754 -1.665 12.947 1.00 0.00 H ATOM 438 N LEU A 42 -24.807 -2.629 10.430 1.00 28.12 N ATOM 439 CA LEU A 42 -25.368 -2.852 9.096 1.00 30.85 C ATOM 440 C LEU A 42 -24.614 -3.979 8.361 1.00 31.25 C ATOM 441 O LEU A 42 -25.230 -4.839 7.730 1.00 29.19 O ATOM 442 CB LEU A 42 -25.177 -1.585 8.277 1.00 30.81 C ATOM 443 CG LEU A 42 -26.375 -0.712 7.955 1.00 52.59 C ATOM 444 CD1 LEU A 42 -25.879 0.539 7.210 1.00 49.80 C ATOM 445 CD2 LEU A 42 -27.383 -1.525 7.124 1.00 50.08 C ATOM 446 H LEU A 42 -24.424 -1.696 10.683 1.00 0.00 H ATOM 447 N GLU A 43 -23.295 -3.953 8.432 1.00 29.51 N ATOM 448 CA GLU A 43 -22.475 -4.958 7.761 1.00 32.15 C ATOM 449 C GLU A 43 -22.790 -6.357 8.327 1.00 28.09 C ATOM 450 O GLU A 43 -22.889 -7.361 7.581 1.00 31.81 O ATOM 451 CB GLU A 43 -20.973 -4.665 7.895 1.00 31.22 C ATOM 452 CG GLU A 43 -20.188 -5.737 7.084 1.00 38.48 C ATOM 453 CD GLU A 43 -18.721 -5.429 6.821 1.00 45.45 C ATOM 454 OE1 GLU A 43 -18.144 -4.524 7.457 1.00 51.30 O ATOM 455 OE2 GLU A 43 -18.133 -6.126 5.964 1.00 55.86 O ATOM 456 H GLU A 43 -22.830 -3.200 8.978 1.00 0.00 H ATOM 457 N VAL A 44 -22.963 -6.437 9.634 1.00 30.13 N ATOM 458 CA VAL A 44 -23.339 -7.715 10.244 1.00 30.08 C ATOM 459 C VAL A 44 -24.737 -8.148 9.747 1.00 33.60 C ATOM 460 O VAL A 44 -24.958 -9.333 9.450 1.00 30.21 O ATOM 461 CB VAL A 44 -23.323 -7.682 11.814 1.00 29.25 C ATOM 462 CG1 VAL A 44 -23.995 -8.962 12.390 1.00 32.29 C ATOM 463 CG2 VAL A 44 -21.925 -7.498 12.383 1.00 32.33 C ATOM 464 H VAL A 44 -22.833 -5.594 10.229 1.00 0.00 H ATOM 465 N CYS A 45 -25.694 -7.222 9.668 1.00 29.70 N ATOM 466 CA CYS A 45 -26.989 -7.604 9.111 1.00 31.23 C ATOM 467 C CYS A 45 -26.862 -8.136 7.686 1.00 31.89 C ATOM 468 O CYS A 45 -27.518 -9.138 7.321 1.00 29.61 O ATOM 469 CB CYS A 45 -27.964 -6.431 9.143 1.00 31.37 C ATOM 470 SG CYS A 45 -28.480 -5.994 10.810 1.00 32.60 S ATOM 471 H CYS A 45 -25.522 -6.250 9.996 1.00 0.00 H ATOM 472 N PHE A 46 -26.031 -7.479 6.874 1.00 26.58 N ATOM 473 CA PHE A 46 -25.863 -7.923 5.468 1.00 35.74 C ATOM 474 C PHE A 46 -25.161 -9.271 5.365 1.00 31.56 C ATOM 475 O PHE A 46 -25.485 -10.125 4.492 1.00 32.34 O ATOM 476 CB PHE A 46 -25.135 -6.859 4.625 1.00 33.63 C ATOM 477 CG PHE A 46 -25.987 -5.626 4.342 1.00 36.83 C ATOM 478 CD1 PHE A 46 -27.237 -5.493 4.916 1.00 50.11 C ATOM 479 CD2 PHE A 46 -25.547 -4.620 3.515 1.00 61.55 C ATOM 480 CE1 PHE A 46 -28.030 -4.391 4.688 1.00 53.11 C ATOM 481 CE2 PHE A 46 -26.360 -3.512 3.277 1.00 56.31 C ATOM 482 CZ PHE A 46 -27.593 -3.418 3.872 1.00 46.94 C ATOM 483 H PHE A 46 -25.501 -6.656 7.227 1.00 0.00 H ATOM 484 N MET A 47 -24.191 -9.481 6.226 1.00 29.46 N ATOM 485 CA MET A 47 -23.467 -10.758 6.216 1.00 33.88 C ATOM 486 C MET A 47 -24.384 -11.890 6.670 1.00 34.43 C ATOM 487 O MET A 47 -24.344 -13.016 6.152 1.00 32.44 O ATOM 488 CB MET A 47 -22.234 -10.692 7.122 1.00 32.11 C ATOM 489 CG MET A 47 -21.089 -9.776 6.591 1.00 31.99 C ATOM 490 SD MET A 47 -19.648 -9.860 7.680 1.00 35.24 S ATOM 491 CE MET A 47 -19.130 -11.535 7.333 1.00 33.62 C ATOM 492 H MET A 47 -23.936 -8.744 6.914 1.00 0.00 H ATOM 493 N TYR A 48 -25.230 -11.596 7.640 1.00 26.48 N ATOM 494 CA TYR A 48 -26.146 -12.609 8.173 1.00 29.36 C ATOM 495 C TYR A 48 -27.125 -13.023 7.063 1.00 30.04 C ATOM 496 O TYR A 48 -27.394 -14.218 6.835 1.00 29.13 O ATOM 497 CB TYR A 48 -26.918 -11.990 9.328 1.00 29.37 C ATOM 498 CG TYR A 48 -27.528 -12.934 10.328 1.00 27.76 C ATOM 499 CD1 TYR A 48 -28.693 -13.621 10.058 1.00 29.90 C ATOM 500 CD2 TYR A 48 -26.923 -13.107 11.560 1.00 23.74 C ATOM 501 CE1 TYR A 48 -29.281 -14.498 11.027 1.00 31.89 C ATOM 502 CE2 TYR A 48 -27.469 -13.958 12.517 1.00 29.74 C ATOM 503 CZ TYR A 48 -28.634 -14.639 12.247 1.00 33.74 C ATOM 504 OH TYR A 48 -29.152 -15.452 13.232 1.00 32.06 O ATOM 505 HH TYR A 48 -29.351 -14.909 14.035 1.00 0.00 H ATOM 506 H TYR A 48 -25.247 -10.633 8.031 1.00 0.00 H ATOM 507 N SER A 49 -27.687 -12.032 6.386 1.00 27.79 N ATOM 508 CA SER A 49 -28.548 -12.314 5.228 1.00 30.31 C ATOM 509 C SER A 49 -27.813 -13.081 4.107 1.00 38.26 C ATOM 510 O SER A 49 -28.330 -14.043 3.500 1.00 34.69 O ATOM 511 CB SER A 49 -29.113 -11.009 4.671 1.00 32.81 C ATOM 512 OG SER A 49 -29.928 -11.309 3.543 1.00 41.15 O ATOM 513 HG SER A 49 -29.381 -11.761 2.853 1.00 0.00 H ATOM 514 H SER A 49 -27.518 -11.048 6.676 1.00 0.00 H ATOM 515 N ASP A 50 -26.604 -12.653 3.809 1.00 30.61 N ATOM 516 CA ASP A 50 -25.844 -13.293 2.734 1.00 34.28 C ATOM 517 C ASP A 50 -25.406 -14.725 3.016 1.00 43.63 C ATOM 518 O ASP A 50 -25.075 -15.458 2.081 1.00 38.40 O ATOM 519 CB ASP A 50 -24.593 -12.502 2.416 1.00 30.55 C ATOM 520 CG ASP A 50 -24.903 -11.238 1.612 1.00 52.35 C ATOM 521 OD1 ASP A 50 -26.056 -11.089 1.124 1.00 51.11 O ATOM 522 OD2 ASP A 50 -23.996 -10.378 1.500 1.00 52.58 O ATOM 523 H ASP A 50 -26.189 -11.860 4.338 1.00 0.00 H ATOM 524 N ALA A 51 -25.379 -15.112 4.293 1.00 35.74 N ATOM 525 CA ALA A 51 -25.066 -16.482 4.667 1.00 37.04 C ATOM 526 C ALA A 51 -26.020 -17.501 4.020 1.00 43.77 C ATOM 527 O ALA A 51 -25.672 -18.677 3.872 1.00 40.69 O ATOM 528 CB ALA A 51 -25.063 -16.617 6.198 1.00 34.59 C ATOM 529 H ALA A 51 -25.587 -14.417 5.038 1.00 0.00 H ATOM 530 N SER A 52 -27.211 -17.051 3.633 1.00 36.13 N ATOM 531 CA SER A 52 -28.189 -17.904 2.979 1.00 40.43 C ATOM 532 C SER A 52 -29.081 -17.046 2.092 1.00 38.97 C ATOM 533 O SER A 52 -30.162 -16.583 2.506 1.00 35.20 O ATOM 534 CB SER A 52 -29.021 -18.667 4.014 1.00 49.24 C ATOM 535 OG SER A 52 -29.782 -19.669 3.362 1.00 47.12 O ATOM 536 HG SER A 52 -30.319 -20.162 4.032 1.00 0.00 H ATOM 537 H SER A 52 -27.450 -16.054 3.805 1.00 0.00 H ATOM 538 N LYS A 73 -28.617 -16.810 0.869 1.00 38.24 N ATOM 539 CA LYS A 73 -29.272 -15.814 0.010 1.00 42.93 C ATOM 540 C LYS A 73 -30.747 -16.113 -0.250 1.00 47.03 C ATOM 541 O LYS A 73 -31.141 -17.261 -0.486 1.00 49.18 O ATOM 542 CB LYS A 73 -28.469 -15.625 -1.278 1.00 59.26 C ATOM 543 CG LYS A 73 -27.048 -15.127 -1.030 1.00 59.14 C ATOM 544 CD LYS A 73 -26.117 -15.488 -2.185 1.00 71.72 C ATOM 545 CE LYS A 73 -24.818 -14.678 -2.144 1.00 81.11 C ATOM 546 NZ LYS A 73 -23.858 -15.124 -1.077 1.00 76.27 N ATOM 547 HZ1 LYS A 73 -24.310 -15.031 -0.145 1.00 0.00 H ATOM 548 HZ2 LYS A 73 -23.598 -16.118 -1.240 1.00 0.00 H ATOM 549 HZ3 LYS A 73 -23.004 -14.531 -1.110 1.00 0.00 H ATOM 550 H LYS A 73 -27.788 -17.332 0.519 1.00 0.00 H ATOM 551 N HIS A 74 -31.560 -15.074 -0.113 1.00 42.22 N ATOM 552 CA HIS A 74 -33.022 -15.153 -0.199 1.00 44.56 C ATOM 553 C HIS A 74 -33.798 -15.819 0.916 1.00 42.05 C ATOM 554 O HIS A 74 -35.022 -15.798 0.909 1.00 39.26 O ATOM 555 CB HIS A 74 -33.451 -15.639 -1.575 1.00 52.99 C ATOM 556 CG HIS A 74 -32.817 -14.839 -2.655 1.00 53.04 C ATOM 557 ND1 HIS A 74 -32.940 -13.467 -2.711 1.00 52.51 N ATOM 558 CD2 HIS A 74 -31.956 -15.184 -3.639 1.00 56.07 C ATOM 559 CE1 HIS A 74 -32.231 -13.010 -3.729 1.00 50.46 C ATOM 560 NE2 HIS A 74 -31.621 -14.030 -4.304 1.00 50.09 N ATOM 561 H HIS A 74 -31.133 -14.143 0.067 1.00 0.00 H ATOM 562 N ARG A 75 -33.113 -16.362 1.905 1.00 34.41 N ATOM 563 CA ARG A 75 -33.839 -16.820 3.067 1.00 28.99 C ATOM 564 C ARG A 75 -34.329 -15.650 3.923 1.00 27.50 C ATOM 565 O ARG A 75 -35.315 -15.780 4.654 1.00 31.26 O ATOM 566 CB ARG A 75 -32.920 -17.690 3.913 1.00 33.57 C ATOM 567 CG ARG A 75 -33.634 -18.274 5.115 1.00 35.72 C ATOM 568 CD ARG A 75 -32.655 -19.111 5.900 1.00 36.87 C ATOM 569 NE ARG A 75 -33.089 -19.286 7.266 1.00 36.73 N ATOM 570 CZ ARG A 75 -32.525 -20.154 8.097 1.00 39.03 C ATOM 571 NH1 ARG A 75 -31.555 -20.934 7.653 1.00 42.26 N ATOM 572 NH2 ARG A 75 -32.956 -20.254 9.349 1.00 37.76 N ATOM 573 HE ARG A 75 -33.879 -18.706 7.614 1.00 0.00 H ATOM 574 HH12 ARG A 75 -31.104 -21.619 8.293 1.00 0.00 H ATOM 575 HH11 ARG A 75 -31.243 -20.863 6.664 1.00 0.00 H ATOM 576 HH22 ARG A 75 -32.513 -20.935 9.999 1.00 0.00 H ATOM 577 HH21 ARG A 75 -33.737 -19.652 9.680 1.00 0.00 H ATOM 578 H ARG A 75 -32.079 -16.458 1.849 1.00 0.00 H ATOM 579 N PHE A 76 -33.594 -14.524 3.894 1.00 30.93 N ATOM 580 CA PHE A 76 -33.891 -13.397 4.786 1.00 31.67 C ATOM 581 C PHE A 76 -34.314 -12.143 4.025 1.00 31.84 C ATOM 582 O PHE A 76 -33.656 -11.745 3.054 1.00 35.73 O ATOM 583 CB PHE A 76 -32.623 -13.026 5.620 1.00 30.39 C ATOM 584 CG PHE A 76 -32.087 -14.165 6.445 1.00 32.10 C ATOM 585 CD1 PHE A 76 -32.696 -14.511 7.668 1.00 30.42 C ATOM 586 CD2 PHE A 76 -31.015 -14.921 5.985 1.00 29.01 C ATOM 587 CE1 PHE A 76 -32.211 -15.577 8.433 1.00 30.15 C ATOM 588 CE2 PHE A 76 -30.555 -16.020 6.723 1.00 31.69 C ATOM 589 CZ PHE A 76 -31.128 -16.328 7.951 1.00 33.58 C ATOM 590 H PHE A 76 -32.800 -14.451 3.227 1.00 0.00 H ATOM 591 N GLU A 77 -35.372 -11.483 4.477 1.00 30.21 N ATOM 592 CA GLU A 77 -35.645 -10.118 3.990 1.00 29.70 C ATOM 593 C GLU A 77 -34.876 -9.154 4.914 1.00 34.59 C ATOM 594 O GLU A 77 -34.905 -9.316 6.114 1.00 30.53 O ATOM 595 CB GLU A 77 -37.142 -9.815 4.106 1.00 29.57 C ATOM 596 CG GLU A 77 -37.624 -8.749 3.112 1.00 31.80 C ATOM 597 CD GLU A 77 -37.557 -9.273 1.654 1.00 37.13 C ATOM 598 OE1 GLU A 77 -38.350 -10.170 1.299 1.00 41.29 O ATOM 599 OE2 GLU A 77 -36.673 -8.819 0.895 1.00 38.78 O ATOM 600 H GLU A 77 -36.006 -11.926 5.172 1.00 0.00 H ATOM 601 N ILE A 78 -34.229 -8.138 4.365 1.00 28.95 N ATOM 602 CA ILE A 78 -33.541 -7.151 5.187 1.00 30.60 C ATOM 603 C ILE A 78 -34.429 -5.979 5.490 1.00 32.56 C ATOM 604 O ILE A 78 -35.048 -5.406 4.567 1.00 33.04 O ATOM 605 CB ILE A 78 -32.278 -6.647 4.491 1.00 35.37 C ATOM 606 CG1 ILE A 78 -31.339 -7.834 4.255 1.00 37.47 C ATOM 607 CG2 ILE A 78 -31.553 -5.631 5.394 1.00 36.46 C ATOM 608 CD1 ILE A 78 -30.194 -7.524 3.365 1.00 42.46 C ATOM 609 H ILE A 78 -34.211 -8.043 3.330 1.00 0.00 H ATOM 610 N ILE A 79 -34.510 -5.610 6.768 1.00 28.18 N ATOM 611 CA ILE A 79 -35.377 -4.497 7.193 1.00 31.81 C ATOM 612 C ILE A 79 -34.477 -3.291 7.507 1.00 36.84 C ATOM 613 O ILE A 79 -34.755 -2.147 7.096 1.00 31.15 O ATOM 614 CB ILE A 79 -36.230 -4.863 8.435 1.00 34.37 C ATOM 615 CG1 ILE A 79 -36.970 -6.196 8.242 1.00 34.66 C ATOM 616 CG2 ILE A 79 -37.230 -3.736 8.825 1.00 31.39 C ATOM 617 CD1 ILE A 79 -37.819 -6.257 7.021 1.00 43.93 C ATOM 618 H ILE A 79 -33.949 -6.119 7.481 1.00 0.00 H ATOM 619 N GLU A 80 -33.385 -3.561 8.228 1.00 30.73 N ATOM 620 CA GLU A 80 -32.428 -2.520 8.644 1.00 31.12 C ATOM 621 C GLU A 80 -31.824 -1.827 7.429 1.00 37.04 C ATOM 622 O GLU A 80 -31.673 -2.438 6.384 1.00 39.68 O ATOM 623 CB GLU A 80 -31.310 -3.174 9.472 1.00 31.61 C ATOM 624 CG GLU A 80 -30.264 -2.233 10.090 1.00 34.07 C ATOM 625 CD GLU A 80 -30.904 -1.240 11.044 1.00 36.25 C ATOM 626 OE1 GLU A 80 -31.103 -1.538 12.281 1.00 35.70 O ATOM 627 OE2 GLU A 80 -31.219 -0.156 10.490 1.00 36.57 O ATOM 628 H GLU A 80 -33.203 -4.546 8.507 1.00 0.00 H ATOM 629 N GLY A 81 -31.477 -0.547 7.551 1.00 32.13 N ATOM 630 CA GLY A 81 -30.818 0.125 6.464 1.00 31.25 C ATOM 631 C GLY A 81 -31.785 0.832 5.496 1.00 42.70 C ATOM 632 O GLY A 81 -31.370 1.677 4.709 1.00 48.68 O ATOM 633 H GLY A 81 -31.683 -0.034 8.432 1.00 0.00 H ATOM 634 N ARG A 82 -33.064 0.489 5.563 1.00 37.05 N ATOM 635 CA ARG A 82 -34.094 1.162 4.773 1.00 37.95 C ATOM 636 C ARG A 82 -34.526 2.405 5.547 1.00 47.90 C ATOM 637 O ARG A 82 -34.401 2.440 6.764 1.00 38.09 O ATOM 638 CB ARG A 82 -35.293 0.232 4.637 1.00 34.68 C ATOM 639 CG ARG A 82 -35.005 -1.035 3.844 1.00 36.30 C ATOM 640 CD ARG A 82 -36.279 -1.807 3.672 1.00 34.17 C ATOM 641 NE ARG A 82 -36.088 -3.194 3.272 1.00 31.16 N ATOM 642 CZ ARG A 82 -36.218 -3.641 2.034 1.00 40.38 C ATOM 643 NH1 ARG A 82 -36.515 -2.797 1.045 1.00 40.92 N ATOM 644 NH2 ARG A 82 -36.042 -4.922 1.783 1.00 31.28 N ATOM 645 HE ARG A 82 -35.832 -3.880 4.010 1.00 0.00 H ATOM 646 HH12 ARG A 82 -36.617 -3.151 0.072 1.00 0.00 H ATOM 647 HH11 ARG A 82 -36.645 -1.785 1.246 1.00 0.00 H ATOM 648 HH22 ARG A 82 -36.143 -5.280 0.812 1.00 0.00 H ATOM 649 HH21 ARG A 82 -35.802 -5.575 2.556 1.00 0.00 H ATOM 650 H ARG A 82 -33.344 -0.285 6.199 1.00 0.00 H ATOM 651 N ASP A 83 -35.060 3.419 4.870 1.00 41.96 N ATOM 652 CA ASP A 83 -35.597 4.561 5.600 1.00 43.37 C ATOM 653 C ASP A 83 -36.814 4.047 6.362 1.00 41.81 C ATOM 654 O ASP A 83 -37.393 3.028 5.985 1.00 39.13 O ATOM 655 CB ASP A 83 -35.941 5.711 4.653 1.00 45.80 C ATOM 656 CG ASP A 83 -37.031 5.333 3.677 1.00 54.04 C ATOM 657 OD1 ASP A 83 -38.216 5.463 4.050 1.00 60.28 O ATOM 658 OD2 ASP A 83 -36.712 4.884 2.542 1.00 73.83 O ATOM 659 H ASP A 83 -35.094 3.397 3.831 1.00 0.00 H ATOM 660 N ARG A 84 -37.202 4.724 7.441 1.00 39.20 N ATOM 661 CA ARG A 84 -38.195 4.165 8.357 1.00 41.91 C ATOM 662 C ARG A 84 -39.582 3.870 7.782 1.00 45.28 C ATOM 663 O ARG A 84 -40.203 2.848 8.124 1.00 41.62 O ATOM 664 CB ARG A 84 -38.396 5.079 9.564 1.00 42.71 C ATOM 665 CG ARG A 84 -39.132 4.351 10.656 1.00 58.68 C ATOM 666 CD ARG A 84 -40.098 5.200 11.433 1.00 66.62 C ATOM 667 NE ARG A 84 -39.496 5.707 12.656 1.00 81.48 N ATOM 668 CZ ARG A 84 -39.339 4.996 13.770 1.00 80.89 C ATOM 669 NH1 ARG A 84 -39.737 3.719 13.824 1.00 74.10 N ATOM 670 NH2 ARG A 84 -38.788 5.574 14.841 1.00 80.47 N ATOM 671 HE ARG A 84 -39.165 6.693 12.660 1.00 0.00 H ATOM 672 HH12 ARG A 84 -39.610 3.171 14.699 1.00 0.00 H ATOM 673 HH11 ARG A 84 -40.173 3.275 12.991 1.00 0.00 H ATOM 674 HH22 ARG A 84 -38.660 5.029 15.718 1.00 0.00 H ATOM 675 HH21 ARG A 84 -38.487 6.569 14.798 1.00 0.00 H ATOM 676 H ARG A 84 -36.794 5.661 7.634 1.00 0.00 H ATOM 677 N THR A 85 -40.109 4.804 6.979 1.00 41.18 N ATOM 678 CA THR A 85 -41.428 4.621 6.397 1.00 39.73 C ATOM 679 C THR A 85 -41.381 3.383 5.492 1.00 35.68 C ATOM 680 O THR A 85 -42.264 2.514 5.559 1.00 40.51 O ATOM 681 CB THR A 85 -41.848 5.855 5.587 1.00 49.66 C ATOM 682 OG1 THR A 85 -41.827 7.016 6.436 1.00 50.38 O ATOM 683 CG2 THR A 85 -43.223 5.670 5.059 1.00 44.40 C ATOM 684 HG1 THR A 85 -42.098 7.811 5.912 1.00 0.00 H ATOM 685 H THR A 85 -39.569 5.668 6.770 1.00 0.00 H ATOM 686 N MET A 86 -40.341 3.297 4.664 1.00 34.75 N ATOM 687 CA MET A 86 -40.190 2.124 3.801 1.00 38.87 C ATOM 688 C MET A 86 -40.036 0.820 4.621 1.00 39.46 C ATOM 689 O MET A 86 -40.643 -0.215 4.302 1.00 38.82 O ATOM 690 CB MET A 86 -39.010 2.326 2.838 1.00 35.40 C ATOM 691 CG MET A 86 -38.760 1.126 1.959 1.00 45.89 C ATOM 692 SD MET A 86 -40.082 0.893 0.677 1.00 47.52 S ATOM 693 CE MET A 86 -39.320 -0.496 -0.181 1.00 42.77 C ATOM 694 H MET A 86 -39.637 4.062 4.631 1.00 0.00 H ATOM 695 N ALA A 87 -39.249 0.869 5.696 1.00 37.02 N ATOM 696 CA ALA A 87 -39.068 -0.312 6.549 1.00 34.93 C ATOM 697 C ALA A 87 -40.397 -0.810 7.096 1.00 34.31 C ATOM 698 O ALA A 87 -40.686 -2.008 7.066 1.00 33.75 O ATOM 699 CB ALA A 87 -38.079 -0.025 7.666 1.00 38.35 C ATOM 700 H ALA A 87 -38.757 1.754 5.933 1.00 0.00 H ATOM 701 N TRP A 88 -41.250 0.109 7.556 1.00 35.75 N ATOM 702 CA TRP A 88 -42.536 -0.332 8.086 1.00 37.09 C ATOM 703 C TRP A 88 -43.449 -0.888 7.002 1.00 34.83 C ATOM 704 O TRP A 88 -44.156 -1.882 7.229 1.00 36.66 O ATOM 705 CB TRP A 88 -43.243 0.818 8.859 1.00 43.51 C ATOM 706 CG TRP A 88 -42.776 0.890 10.302 1.00 41.40 C ATOM 707 CD1 TRP A 88 -42.028 1.877 10.886 1.00 43.71 C ATOM 708 CD2 TRP A 88 -42.983 -0.098 11.302 1.00 36.18 C ATOM 709 NE1 TRP A 88 -41.787 1.571 12.193 1.00 40.08 N ATOM 710 CE2 TRP A 88 -42.366 0.351 12.479 1.00 38.34 C ATOM 711 CE3 TRP A 88 -43.648 -1.320 11.328 1.00 35.69 C ATOM 712 CZ2 TRP A 88 -42.400 -0.361 13.661 1.00 40.93 C ATOM 713 CZ3 TRP A 88 -43.666 -2.047 12.500 1.00 47.59 C ATOM 714 CH2 TRP A 88 -43.044 -1.558 13.655 1.00 48.14 C ATOM 715 HE1 TRP A 88 -41.254 2.160 12.864 1.00 0.00 H ATOM 716 H TRP A 88 -41.003 1.119 7.537 1.00 0.00 H ATOM 717 N THR A 89 -43.460 -0.260 5.824 1.00 36.95 N ATOM 718 CA THR A 89 -44.278 -0.874 4.742 1.00 38.59 C ATOM 719 C THR A 89 -43.801 -2.298 4.397 1.00 35.92 C ATOM 720 O THR A 89 -44.601 -3.210 4.185 1.00 38.15 O ATOM 721 CB THR A 89 -44.387 0.008 3.452 1.00 45.46 C ATOM 722 OG1 THR A 89 -43.197 -0.105 2.676 1.00 49.35 O ATOM 723 CG2 THR A 89 -44.637 1.467 3.786 1.00 41.99 C ATOM 724 HG1 THR A 89 -43.279 0.456 1.865 1.00 0.00 H ATOM 725 H THR A 89 -42.923 0.617 5.669 1.00 0.00 H ATOM 726 N VAL A 90 -42.489 -2.519 4.381 1.00 33.07 N ATOM 727 CA VAL A 90 -41.999 -3.892 4.204 1.00 32.34 C ATOM 728 C VAL A 90 -42.423 -4.860 5.322 1.00 31.92 C ATOM 729 O VAL A 90 -42.927 -5.982 5.054 1.00 32.32 O ATOM 730 CB VAL A 90 -40.464 -3.910 3.988 1.00 28.92 C ATOM 731 CG1 VAL A 90 -39.906 -5.348 4.064 1.00 33.84 C ATOM 732 CG2 VAL A 90 -40.095 -3.242 2.673 1.00 32.68 C ATOM 733 H VAL A 90 -41.820 -1.731 4.492 1.00 0.00 H ATOM 734 N VAL A 91 -42.241 -4.451 6.574 1.00 35.93 N ATOM 735 CA VAL A 91 -42.670 -5.275 7.707 1.00 34.25 C ATOM 736 C VAL A 91 -44.183 -5.621 7.633 1.00 35.17 C ATOM 737 O VAL A 91 -44.589 -6.782 7.818 1.00 38.31 O ATOM 738 CB VAL A 91 -42.327 -4.561 9.071 1.00 33.40 C ATOM 739 CG1 VAL A 91 -43.030 -5.224 10.281 1.00 38.00 C ATOM 740 CG2 VAL A 91 -40.794 -4.483 9.296 1.00 32.09 C ATOM 741 H VAL A 91 -41.787 -3.532 6.752 1.00 0.00 H ATOM 742 N ASN A 92 -44.997 -4.605 7.366 1.00 39.66 N ATOM 743 CA ASN A 92 -46.454 -4.758 7.207 1.00 39.44 C ATOM 744 C ASN A 92 -46.792 -5.706 6.068 1.00 38.82 C ATOM 745 O ASN A 92 -47.646 -6.562 6.207 1.00 38.92 O ATOM 746 CB ASN A 92 -47.122 -3.372 7.003 1.00 40.85 C ATOM 747 CG ASN A 92 -47.245 -2.581 8.303 1.00 46.25 C ATOM 748 OD1 ASN A 92 -47.380 -3.161 9.376 1.00 53.29 O ATOM 749 ND2 ASN A 92 -47.179 -1.258 8.211 1.00 54.14 N ATOM 750 HD22 ASN A 92 -47.064 -0.806 7.281 1.00 0.00 H ATOM 751 HD21 ASN A 92 -47.242 -0.673 9.069 1.00 0.00 H ATOM 752 H ASN A 92 -44.586 -3.655 7.264 1.00 0.00 H ATOM 753 N SER A 93 -46.087 -5.588 4.940 1.00 39.39 N ATOM 754 CA SER A 93 -46.307 -6.516 3.821 1.00 40.31 C ATOM 755 C SER A 93 -45.993 -7.947 4.241 1.00 40.45 C ATOM 756 O SER A 93 -46.738 -8.881 3.945 1.00 39.43 O ATOM 757 CB SER A 93 -45.452 -6.105 2.590 1.00 34.56 C ATOM 758 OG SER A 93 -45.567 -7.059 1.544 1.00 40.41 O ATOM 759 HG SER A 93 -45.253 -7.941 1.867 1.00 0.00 H ATOM 760 H SER A 93 -45.377 -4.834 4.852 1.00 0.00 H ATOM 761 N ILE A 94 -44.865 -8.142 4.911 1.00 37.83 N ATOM 762 CA ILE A 94 -44.492 -9.480 5.316 1.00 29.67 C ATOM 763 C ILE A 94 -45.575 -10.017 6.265 1.00 37.92 C ATOM 764 O ILE A 94 -45.965 -11.173 6.186 1.00 43.60 O ATOM 765 CB ILE A 94 -43.101 -9.473 6.064 1.00 34.41 C ATOM 766 CG1 ILE A 94 -41.940 -9.273 5.057 1.00 35.51 C ATOM 767 CG2 ILE A 94 -42.911 -10.743 6.870 1.00 36.84 C ATOM 768 CD1 ILE A 94 -40.572 -8.935 5.724 1.00 33.21 C ATOM 769 H ILE A 94 -44.251 -7.336 5.144 1.00 0.00 H ATOM 770 N CYS A 95 -46.044 -9.189 7.183 1.00 35.97 N ATOM 771 CA CYS A 95 -47.017 -9.702 8.157 1.00 40.24 C ATOM 772 C CYS A 95 -48.300 -10.103 7.429 1.00 46.93 C ATOM 773 O CYS A 95 -48.847 -11.179 7.658 1.00 44.96 O ATOM 774 CB CYS A 95 -47.309 -8.672 9.249 1.00 43.67 C ATOM 775 SG CYS A 95 -45.876 -8.379 10.364 1.00 46.14 S ATOM 776 H CYS A 95 -45.731 -8.198 7.215 1.00 0.00 H ATOM 777 N ASN A 96 -48.749 -9.250 6.518 1.00 48.64 N ATOM 778 CA ASN A 96 -49.930 -9.582 5.727 1.00 51.36 C ATOM 779 C ASN A 96 -49.779 -10.869 4.921 1.00 53.77 C ATOM 780 O ASN A 96 -50.655 -11.726 4.921 1.00 50.83 O ATOM 781 CB ASN A 96 -50.311 -8.423 4.817 1.00 43.60 C ATOM 782 CG ASN A 96 -51.691 -8.621 4.216 1.00 70.55 C ATOM 783 OD1 ASN A 96 -52.696 -8.456 4.905 1.00 70.10 O ATOM 784 ND2 ASN A 96 -51.747 -9.026 2.948 1.00 56.29 N ATOM 785 HD22 ASN A 96 -50.870 -9.152 2.403 1.00 0.00 H ATOM 786 HD21 ASN A 96 -52.668 -9.216 2.503 1.00 0.00 H ATOM 787 H ASN A 96 -48.260 -8.345 6.367 1.00 0.00 H ATOM 788 N THR A 97 -48.648 -11.024 4.249 1.00 46.80 N ATOM 789 CA THR A 97 -48.380 -12.217 3.457 1.00 43.13 C ATOM 790 C THR A 97 -48.182 -13.504 4.244 1.00 50.33 C ATOM 791 O THR A 97 -48.746 -14.533 3.899 1.00 44.15 O ATOM 792 CB THR A 97 -47.129 -11.987 2.556 1.00 45.85 C ATOM 793 OG1 THR A 97 -47.430 -10.966 1.598 1.00 43.55 O ATOM 794 CG2 THR A 97 -46.699 -13.266 1.854 1.00 45.42 C ATOM 795 HG1 THR A 97 -46.640 -10.813 1.021 1.00 0.00 H ATOM 796 H THR A 97 -47.930 -10.272 4.288 1.00 0.00 H ATOM 797 N THR A 98 -47.346 -13.468 5.271 1.00 44.01 N ATOM 798 CA THR A 98 -46.965 -14.673 5.981 1.00 43.52 C ATOM 799 C THR A 98 -47.846 -14.897 7.193 1.00 47.99 C ATOM 800 O THR A 98 -47.833 -15.985 7.767 1.00 48.33 O ATOM 801 CB THR A 98 -45.543 -14.578 6.535 1.00 41.64 C ATOM 802 OG1 THR A 98 -45.515 -13.579 7.572 1.00 42.67 O ATOM 803 CG2 THR A 98 -44.536 -14.258 5.415 1.00 42.01 C ATOM 804 HG1 THR A 98 -45.788 -12.705 7.194 1.00 0.00 H ATOM 805 H THR A 98 -46.954 -12.554 5.575 1.00 0.00 H ATOM 806 N GLY A 99 -48.571 -13.859 7.599 1.00 46.72 N ATOM 807 CA GLY A 99 -49.346 -13.912 8.830 1.00 55.68 C ATOM 808 C GLY A 99 -48.533 -13.862 10.119 1.00 59.77 C ATOM 809 O GLY A 99 -49.077 -14.101 11.197 1.00 51.91 O ATOM 810 H GLY A 99 -48.585 -12.992 7.025 1.00 0.00 H ATOM 811 N ALA A 100 -47.237 -13.574 10.018 1.00 47.59 N ATOM 812 CA ALA A 100 -46.416 -13.277 11.200 1.00 51.49 C ATOM 813 C ALA A 100 -47.009 -12.148 12.053 1.00 50.30 C ATOM 814 O ALA A 100 -47.578 -11.200 11.528 1.00 48.89 O ATOM 815 CB ALA A 100 -44.974 -12.921 10.783 1.00 41.25 C ATOM 816 H ALA A 100 -46.794 -13.559 9.077 1.00 0.00 H ATOM 817 N GLU A 101 -46.877 -12.240 13.374 1.00 52.05 N ATOM 818 CA GLU A 101 -47.350 -11.143 14.212 1.00 51.48 C ATOM 819 C GLU A 101 -46.523 -9.892 13.982 1.00 51.99 C ATOM 820 O GLU A 101 -45.303 -9.969 13.841 1.00 48.78 O ATOM 821 CB GLU A 101 -47.289 -11.517 15.693 1.00 62.04 C ATOM 822 CG GLU A 101 -48.620 -12.014 16.240 1.00 66.83 C ATOM 823 CD GLU A 101 -48.810 -11.668 17.707 1.00 81.64 C ATOM 824 OE1 GLU A 101 -48.812 -10.461 18.058 1.00 83.52 O ATOM 825 OE2 GLU A 101 -48.956 -12.612 18.511 1.00 87.05 O ATOM 826 H GLU A 101 -46.443 -13.082 13.803 1.00 0.00 H ATOM 827 N LYS A 102 -47.180 -8.738 13.953 1.00 43.57 N ATOM 828 CA LYS A 102 -46.480 -7.479 13.733 1.00 49.44 C ATOM 829 C LYS A 102 -45.658 -7.085 14.946 1.00 51.82 C ATOM 830 O LYS A 102 -46.173 -7.102 16.050 1.00 47.96 O ATOM 831 CB LYS A 102 -47.494 -6.399 13.425 1.00 50.76 C ATOM 832 CG LYS A 102 -46.926 -5.021 13.342 1.00 46.71 C ATOM 833 CD LYS A 102 -48.015 -4.035 12.927 1.00 56.54 C ATOM 834 CE LYS A 102 -47.580 -2.618 13.221 1.00 64.86 C ATOM 835 NZ LYS A 102 -47.688 -1.740 12.016 1.00 74.07 N ATOM 836 HZ1 LYS A 102 -47.083 -2.117 11.259 1.00 0.00 H ATOM 837 HZ2 LYS A 102 -48.676 -1.717 11.693 1.00 0.00 H ATOM 838 HZ3 LYS A 102 -47.380 -0.777 12.261 1.00 0.00 H ATOM 839 H LYS A 102 -48.211 -8.733 14.090 1.00 0.00 H ATOM 840 N PRO A 103 -44.365 -6.755 14.748 1.00 46.34 N ATOM 841 CA PRO A 103 -43.514 -6.357 15.886 1.00 47.06 C ATOM 842 C PRO A 103 -43.755 -4.903 16.318 1.00 49.97 C ATOM 843 O PRO A 103 -44.315 -4.129 15.531 1.00 47.57 O ATOM 844 CB PRO A 103 -42.081 -6.528 15.341 1.00 44.35 C ATOM 845 CG PRO A 103 -42.231 -6.373 13.794 1.00 40.19 C ATOM 846 CD PRO A 103 -43.602 -6.927 13.480 1.00 42.27 C ATOM 847 N LYS A 104 -43.341 -4.523 17.530 1.00 50.44 N ATOM 848 CA LYS A 104 -43.600 -3.146 18.007 1.00 47.38 C ATOM 849 C LYS A 104 -42.485 -2.196 17.691 1.00 49.40 C ATOM 850 O LYS A 104 -42.693 -0.981 17.628 1.00 51.49 O ATOM 851 CB LYS A 104 -43.883 -3.094 19.506 1.00 62.81 C ATOM 852 CG LYS A 104 -45.240 -3.673 19.888 1.00 77.15 C ATOM 853 CD LYS A 104 -45.089 -5.119 20.342 1.00 83.02 C ATOM 854 CE LYS A 104 -46.397 -5.692 20.873 1.00 85.98 C ATOM 855 NZ LYS A 104 -46.334 -7.189 20.957 1.00 90.48 N ATOM 856 HZ1 LYS A 104 -46.158 -7.581 20.010 1.00 0.00 H ATOM 857 HZ2 LYS A 104 -45.563 -7.467 21.598 1.00 0.00 H ATOM 858 HZ3 LYS A 104 -47.238 -7.553 21.321 1.00 0.00 H ATOM 859 H LYS A 104 -42.835 -5.197 18.140 1.00 0.00 H ATOM 860 N PHE A 105 -41.289 -2.751 17.486 1.00 40.02 N ATOM 861 CA PHE A 105 -40.151 -1.959 17.055 1.00 41.06 C ATOM 862 C PHE A 105 -39.634 -2.584 15.756 1.00 37.13 C ATOM 863 O PHE A 105 -39.767 -3.787 15.580 1.00 37.52 O ATOM 864 CB PHE A 105 -39.061 -1.995 18.126 1.00 48.39 C ATOM 865 CG PHE A 105 -39.482 -1.372 19.444 1.00 52.75 C ATOM 866 CD1 PHE A 105 -40.205 -2.109 20.380 1.00 49.71 C ATOM 867 CD2 PHE A 105 -39.166 -0.060 19.727 1.00 61.77 C ATOM 868 CE1 PHE A 105 -40.598 -1.541 21.577 1.00 55.41 C ATOM 869 CE2 PHE A 105 -39.549 0.513 20.932 1.00 69.94 C ATOM 870 CZ PHE A 105 -40.269 -0.226 21.847 1.00 48.73 C ATOM 871 H PHE A 105 -41.169 -3.773 17.638 1.00 0.00 H ATOM 872 N LEU A 106 -39.064 -1.782 14.859 1.00 33.60 N ATOM 873 CA LEU A 106 -38.528 -2.332 13.624 1.00 35.68 C ATOM 874 C LEU A 106 -37.389 -3.280 13.981 1.00 37.93 C ATOM 875 O LEU A 106 -36.437 -2.891 14.689 1.00 36.25 O ATOM 876 CB LEU A 106 -37.958 -1.252 12.723 1.00 38.26 C ATOM 877 CG LEU A 106 -38.945 -0.329 12.053 1.00 45.35 C ATOM 878 CD1 LEU A 106 -38.196 0.855 11.472 1.00 43.61 C ATOM 879 CD2 LEU A 106 -39.656 -1.132 10.983 1.00 39.43 C ATOM 880 H LEU A 106 -39.002 -0.760 15.042 1.00 0.00 H ATOM 881 N PRO A 107 -37.476 -4.508 13.477 1.00 34.76 N ATOM 882 CA PRO A 107 -36.439 -5.534 13.628 1.00 32.51 C ATOM 883 C PRO A 107 -35.416 -5.368 12.522 1.00 31.28 C ATOM 884 O PRO A 107 -35.499 -4.388 11.781 1.00 32.82 O ATOM 885 CB PRO A 107 -37.241 -6.844 13.507 1.00 34.01 C ATOM 886 CG PRO A 107 -38.324 -6.505 12.551 1.00 37.47 C ATOM 887 CD PRO A 107 -38.638 -5.011 12.726 1.00 34.99 C ATOM 888 N ASP A 108 -34.447 -6.284 12.411 1.00 27.72 N ATOM 889 CA ASP A 108 -33.374 -6.122 11.425 1.00 25.59 C ATOM 890 C ASP A 108 -33.602 -7.009 10.189 1.00 27.29 C ATOM 891 O ASP A 108 -33.262 -6.595 9.047 1.00 29.08 O ATOM 892 CB ASP A 108 -32.010 -6.487 12.065 1.00 25.12 C ATOM 893 CG ASP A 108 -31.555 -5.421 13.053 1.00 35.34 C ATOM 894 OD1 ASP A 108 -31.675 -4.249 12.706 1.00 29.14 O ATOM 895 OD2 ASP A 108 -31.131 -5.760 14.150 1.00 28.73 O ATOM 896 H ASP A 108 -34.455 -7.119 13.030 1.00 0.00 H ATOM 897 N LEU A 109 -34.175 -8.194 10.423 1.00 28.08 N ATOM 898 CA LEU A 109 -34.363 -9.165 9.303 1.00 29.89 C ATOM 899 C LEU A 109 -35.679 -9.895 9.485 1.00 34.36 C ATOM 900 O LEU A 109 -36.250 -9.884 10.574 1.00 32.39 O ATOM 901 CB LEU A 109 -33.231 -10.221 9.259 1.00 29.50 C ATOM 902 CG LEU A 109 -31.780 -9.762 9.187 1.00 31.22 C ATOM 903 CD1 LEU A 109 -30.874 -10.979 9.495 1.00 35.54 C ATOM 904 CD2 LEU A 109 -31.400 -9.144 7.828 1.00 30.36 C ATOM 905 H LEU A 109 -34.489 -8.440 11.383 1.00 0.00 H ATOM 906 N TYR A 110 -36.182 -10.493 8.399 1.00 30.93 N ATOM 907 CA TYR A 110 -37.234 -11.513 8.524 1.00 30.61 C ATOM 908 C TYR A 110 -36.700 -12.817 7.965 1.00 31.11 C ATOM 909 O TYR A 110 -36.106 -12.826 6.887 1.00 30.09 O ATOM 910 CB TYR A 110 -38.540 -11.094 7.818 1.00 29.67 C ATOM 911 CG TYR A 110 -39.624 -12.124 8.016 1.00 30.17 C ATOM 912 CD1 TYR A 110 -40.343 -12.178 9.197 1.00 33.28 C ATOM 913 CD2 TYR A 110 -39.907 -13.081 7.013 1.00 34.29 C ATOM 914 CE1 TYR A 110 -41.365 -13.166 9.396 1.00 35.26 C ATOM 915 CE2 TYR A 110 -40.924 -14.058 7.199 1.00 31.01 C ATOM 916 CZ TYR A 110 -41.629 -14.087 8.386 1.00 38.91 C ATOM 917 OH TYR A 110 -42.596 -15.056 8.559 1.00 42.37 O ATOM 918 HH TYR A 110 -42.180 -15.952 8.492 1.00 0.00 H ATOM 919 H TYR A 110 -35.825 -10.234 7.457 1.00 0.00 H ATOM 920 N ASP A 111 -36.876 -13.923 8.713 1.00 33.17 N ATOM 921 CA ASP A 111 -36.330 -15.214 8.336 1.00 28.36 C ATOM 922 C ASP A 111 -37.512 -15.970 7.703 1.00 32.15 C ATOM 923 O ASP A 111 -38.462 -16.340 8.390 1.00 32.21 O ATOM 924 CB ASP A 111 -35.862 -15.983 9.602 1.00 28.19 C ATOM 925 CG ASP A 111 -35.270 -17.348 9.291 1.00 38.19 C ATOM 926 OD1 ASP A 111 -35.578 -17.949 8.216 1.00 35.66 O ATOM 927 OD2 ASP A 111 -34.479 -17.831 10.139 1.00 36.06 O ATOM 928 H ASP A 111 -37.424 -13.849 9.594 1.00 0.00 H ATOM 929 N TYR A 112 -37.462 -16.155 6.396 1.00 34.37 N ATOM 930 CA TYR A 112 -38.585 -16.780 5.683 1.00 40.52 C ATOM 931 C TYR A 112 -38.670 -18.270 5.966 1.00 44.25 C ATOM 932 O TYR A 112 -39.728 -18.888 5.762 1.00 45.00 O ATOM 933 CB TYR A 112 -38.442 -16.578 4.172 1.00 35.57 C ATOM 934 CG TYR A 112 -38.881 -15.208 3.705 1.00 33.20 C ATOM 935 CD1 TYR A 112 -40.202 -14.806 3.837 1.00 34.81 C ATOM 936 CD2 TYR A 112 -37.995 -14.342 3.123 1.00 34.27 C ATOM 937 CE1 TYR A 112 -40.617 -13.570 3.453 1.00 34.38 C ATOM 938 CE2 TYR A 112 -38.405 -13.084 2.704 1.00 33.85 C ATOM 939 CZ TYR A 112 -39.730 -12.711 2.869 1.00 35.25 C ATOM 940 OH TYR A 112 -40.159 -11.464 2.453 1.00 36.78 O ATOM 941 HH TYR A 112 -40.005 -11.371 1.479 1.00 0.00 H ATOM 942 H TYR A 112 -36.619 -15.855 5.866 1.00 0.00 H ATOM 943 N LYS A 113 -37.551 -18.856 6.382 1.00 36.56 N ATOM 944 CA LYS A 113 -37.530 -20.285 6.673 1.00 42.18 C ATOM 945 C LYS A 113 -38.120 -20.588 8.048 1.00 48.94 C ATOM 946 O LYS A 113 -39.049 -21.375 8.154 1.00 43.05 O ATOM 947 CB LYS A 113 -36.125 -20.841 6.581 1.00 36.70 C ATOM 948 CG LYS A 113 -36.107 -22.327 6.898 1.00 45.88 C ATOM 949 CD LYS A 113 -34.722 -22.862 6.896 1.00 52.70 C ATOM 950 CE LYS A 113 -34.704 -24.357 7.226 1.00 60.78 C ATOM 951 NZ LYS A 113 -33.305 -24.861 7.273 1.00 62.69 N ATOM 952 HZ1 LYS A 113 -32.853 -24.712 6.348 1.00 0.00 H ATOM 953 HZ2 LYS A 113 -32.777 -24.345 8.006 1.00 0.00 H ATOM 954 HZ3 LYS A 113 -33.311 -25.876 7.498 1.00 0.00 H ATOM 955 H LYS A 113 -36.685 -18.292 6.501 1.00 0.00 H ATOM 956 N GLU A 114 -37.590 -19.962 9.106 1.00 44.31 N ATOM 957 CA GLU A 114 -38.165 -20.153 10.454 1.00 46.94 C ATOM 958 C GLU A 114 -39.393 -19.262 10.731 1.00 45.50 C ATOM 959 O GLU A 114 -39.932 -19.302 11.830 1.00 46.86 O ATOM 960 CB GLU A 114 -37.104 -19.956 11.568 1.00 37.85 C ATOM 961 CG GLU A 114 -35.813 -20.704 11.338 1.00 43.23 C ATOM 962 CD GLU A 114 -35.940 -22.207 11.606 1.00 60.48 C ATOM 963 OE1 GLU A 114 -35.386 -23.013 10.824 1.00 64.55 O ATOM 964 OE2 GLU A 114 -36.575 -22.581 12.609 1.00 61.81 O ATOM 965 H GLU A 114 -36.768 -19.337 8.979 1.00 0.00 H ATOM 966 N ASN A 115 -39.807 -18.445 9.761 1.00 37.09 N ATOM 967 CA ASN A 115 -41.032 -17.672 9.878 1.00 40.64 C ATOM 968 C ASN A 115 -41.026 -16.673 11.049 1.00 46.10 C ATOM 969 O ASN A 115 -42.023 -16.531 11.764 1.00 41.44 O ATOM 970 CB ASN A 115 -42.270 -18.604 9.980 1.00 48.50 C ATOM 971 CG ASN A 115 -42.276 -19.729 8.920 1.00 55.44 C ATOM 972 OD1 ASN A 115 -42.224 -20.921 9.256 1.00 67.58 O ATOM 973 ND2 ASN A 115 -42.376 -19.353 7.655 1.00 53.62 N ATOM 974 HD22 ASN A 115 -42.417 -18.342 7.415 1.00 0.00 H ATOM 975 HD21 ASN A 115 -42.414 -20.069 6.901 1.00 0.00 H ATOM 976 H ASN A 115 -39.236 -18.359 8.896 1.00 0.00 H ATOM 977 N ARG A 116 -39.922 -15.944 11.228 1.00 35.40 N ATOM 978 CA ARG A 116 -39.868 -14.970 12.332 1.00 36.10 C ATOM 979 C ARG A 116 -38.968 -13.774 12.017 1.00 32.72 C ATOM 980 O ARG A 116 -38.019 -13.899 11.246 1.00 33.68 O ATOM 981 CB ARG A 116 -39.372 -15.666 13.601 1.00 32.32 C ATOM 982 CG ARG A 116 -37.935 -16.207 13.444 1.00 33.85 C ATOM 983 CD ARG A 116 -37.597 -17.316 14.471 1.00 32.33 C ATOM 984 NE ARG A 116 -36.236 -17.798 14.275 1.00 35.08 N ATOM 985 CZ ARG A 116 -35.765 -18.905 14.840 1.00 39.03 C ATOM 986 NH1 ARG A 116 -36.575 -19.628 15.601 1.00 41.60 N ATOM 987 NH2 ARG A 116 -34.522 -19.310 14.617 1.00 38.05 N ATOM 988 HE ARG A 116 -35.601 -17.248 13.662 1.00 0.00 H ATOM 989 HH12 ARG A 116 -36.226 -20.498 16.052 1.00 0.00 H ATOM 990 HH11 ARG A 116 -37.559 -19.326 15.747 1.00 0.00 H ATOM 991 HH22 ARG A 116 -34.169 -20.179 15.067 1.00 0.00 H ATOM 992 HH21 ARG A 116 -33.900 -18.759 13.992 1.00 0.00 H ATOM 993 H ARG A 116 -39.107 -16.063 10.593 1.00 0.00 H ATOM 994 N PHE A 117 -39.246 -12.618 12.628 1.00 32.60 N ATOM 995 CA PHE A 117 -38.321 -11.494 12.554 1.00 30.25 C ATOM 996 C PHE A 117 -37.107 -11.752 13.477 1.00 28.90 C ATOM 997 O PHE A 117 -37.173 -12.582 14.380 1.00 31.17 O ATOM 998 CB PHE A 117 -39.035 -10.196 12.975 1.00 29.72 C ATOM 999 CG PHE A 117 -40.101 -9.763 11.988 1.00 34.96 C ATOM 1000 CD1 PHE A 117 -39.759 -9.105 10.813 1.00 32.32 C ATOM 1001 CD2 PHE A 117 -41.457 -10.030 12.248 1.00 35.03 C ATOM 1002 CE1 PHE A 117 -40.750 -8.705 9.895 1.00 36.25 C ATOM 1003 CE2 PHE A 117 -42.449 -9.637 11.311 1.00 36.12 C ATOM 1004 CZ PHE A 117 -42.078 -8.991 10.152 1.00 34.79 C ATOM 1005 H PHE A 117 -40.133 -12.519 13.162 1.00 0.00 H ATOM 1006 N ILE A 118 -36.000 -11.072 13.202 1.00 29.47 N ATOM 1007 CA ILE A 118 -34.770 -11.276 13.943 1.00 29.48 C ATOM 1008 C ILE A 118 -34.285 -9.891 14.274 1.00 29.65 C ATOM 1009 O ILE A 118 -34.271 -9.004 13.403 1.00 28.45 O ATOM 1010 CB ILE A 118 -33.668 -11.893 13.057 1.00 29.22 C ATOM 1011 CG1 ILE A 118 -34.064 -13.319 12.579 1.00 30.80 C ATOM 1012 CG2 ILE A 118 -32.314 -12.005 13.816 1.00 32.10 C ATOM 1013 CD1 ILE A 118 -32.986 -13.965 11.611 1.00 28.57 C ATOM 1014 H ILE A 118 -36.015 -10.372 12.433 1.00 0.00 H ATOM 1015 N GLU A 119 -33.839 -9.730 15.521 1.00 28.87 N ATOM 1016 CA GLU A 119 -33.069 -8.571 15.969 1.00 31.12 C ATOM 1017 C GLU A 119 -31.590 -8.954 16.153 1.00 28.08 C ATOM 1018 O GLU A 119 -31.265 -9.885 16.894 1.00 28.49 O ATOM 1019 CB GLU A 119 -33.673 -8.034 17.299 1.00 29.50 C ATOM 1020 CG GLU A 119 -32.773 -6.933 17.964 1.00 34.41 C ATOM 1021 CD GLU A 119 -32.627 -5.699 17.107 1.00 40.03 C ATOM 1022 OE1 GLU A 119 -33.657 -5.316 16.470 1.00 34.31 O ATOM 1023 OE2 GLU A 119 -31.466 -5.155 17.041 1.00 37.95 O ATOM 1024 H GLU A 119 -34.052 -10.474 16.216 1.00 0.00 H ATOM 1025 N ILE A 120 -30.685 -8.226 15.493 1.00 27.39 N ATOM 1026 CA ILE A 120 -29.266 -8.513 15.573 1.00 24.53 C ATOM 1027 C ILE A 120 -28.638 -7.470 16.507 1.00 30.40 C ATOM 1028 O ILE A 120 -28.884 -6.259 16.357 1.00 30.60 O ATOM 1029 CB ILE A 120 -28.626 -8.284 14.206 1.00 27.23 C ATOM 1030 CG1 ILE A 120 -29.222 -9.257 13.166 1.00 34.51 C ATOM 1031 CG2 ILE A 120 -27.109 -8.464 14.279 1.00 29.12 C ATOM 1032 CD1 ILE A 120 -28.858 -10.649 13.461 1.00 32.70 C ATOM 1033 H ILE A 120 -31.007 -7.431 14.905 1.00 0.00 H ATOM 1034 N GLY A 121 -27.851 -7.897 17.482 1.00 28.91 N ATOM 1035 CA GLY A 121 -27.135 -6.910 18.313 1.00 33.20 C ATOM 1036 C GLY A 121 -25.633 -7.027 18.112 1.00 38.37 C ATOM 1037 O GLY A 121 -25.137 -8.142 17.915 1.00 32.58 O ATOM 1038 H GLY A 121 -27.739 -8.915 17.660 1.00 0.00 H ATOM 1039 N VAL A 122 -24.892 -5.911 18.144 1.00 25.07 N ATOM 1040 CA VAL A 122 -23.426 -5.981 18.095 1.00 25.24 C ATOM 1041 C VAL A 122 -22.969 -5.164 19.302 1.00 36.61 C ATOM 1042 O VAL A 122 -23.443 -4.033 19.488 1.00 30.14 O ATOM 1043 CB VAL A 122 -22.839 -5.417 16.789 1.00 28.34 C ATOM 1044 CG1 VAL A 122 -21.294 -5.346 16.891 1.00 31.44 C ATOM 1045 CG2 VAL A 122 -23.295 -6.297 15.567 1.00 27.45 C ATOM 1046 H VAL A 122 -25.361 -4.984 18.204 1.00 0.00 H ATOM 1047 N THR A 123 -22.128 -5.756 20.149 1.00 30.59 N ATOM 1048 CA THR A 123 -21.793 -5.109 21.449 1.00 34.53 C ATOM 1049 C THR A 123 -20.372 -5.416 21.875 1.00 34.82 C ATOM 1050 O THR A 123 -19.734 -6.327 21.350 1.00 27.96 O ATOM 1051 CB THR A 123 -22.777 -5.566 22.579 1.00 32.46 C ATOM 1052 OG1 THR A 123 -22.586 -4.803 23.789 1.00 32.83 O ATOM 1053 CG2 THR A 123 -22.552 -7.053 22.914 1.00 33.27 C ATOM 1054 HG1 THR A 123 -22.747 -3.844 23.602 1.00 0.00 H ATOM 1055 H THR A 123 -21.704 -6.673 19.902 1.00 0.00 H ATOM 1056 N ARG A 124 -19.834 -4.627 22.802 1.00 34.00 N ATOM 1057 CA ARG A 124 -18.624 -5.054 23.532 1.00 31.19 C ATOM 1058 C ARG A 124 -18.955 -5.111 25.021 1.00 39.89 C ATOM 1059 O ARG A 124 -18.101 -5.417 25.852 1.00 37.58 O ATOM 1060 CB ARG A 124 -17.406 -4.155 23.233 1.00 35.07 C ATOM 1061 CG ARG A 124 -16.094 -4.556 23.956 1.00 35.37 C ATOM 1062 CD ARG A 124 -15.608 -5.985 23.594 1.00 37.92 C ATOM 1063 NE ARG A 124 -14.440 -6.393 24.392 1.00 43.14 N ATOM 1064 CZ ARG A 124 -14.491 -6.833 25.663 1.00 51.26 C ATOM 1065 NH1 ARG A 124 -15.654 -6.915 26.313 1.00 49.01 N ATOM 1066 NH2 ARG A 124 -13.371 -7.199 26.305 1.00 45.86 N ATOM 1067 HE ARG A 124 -13.505 -6.337 23.940 1.00 0.00 H ATOM 1068 HH12 ARG A 124 -15.678 -7.257 27.295 1.00 0.00 H ATOM 1069 HH11 ARG A 124 -16.536 -6.637 25.838 1.00 0.00 H ATOM 1070 HH22 ARG A 124 -13.422 -7.538 27.287 1.00 0.00 H ATOM 1071 HH21 ARG A 124 -12.452 -7.144 25.821 1.00 0.00 H ATOM 1072 H ARG A 124 -20.268 -3.706 23.013 1.00 0.00 H ATOM 1073 N ARG A 125 -20.221 -4.869 25.367 1.00 33.67 N ATOM 1074 CA ARG A 125 -20.659 -5.138 26.747 1.00 36.21 C ATOM 1075 C ARG A 125 -20.841 -6.649 26.954 1.00 44.36 C ATOM 1076 O ARG A 125 -20.709 -7.447 26.011 1.00 36.79 O ATOM 1077 CB ARG A 125 -21.949 -4.393 27.065 1.00 34.83 C ATOM 1078 CG ARG A 125 -21.793 -2.890 27.048 1.00 40.10 C ATOM 1079 CD ARG A 125 -23.174 -2.236 27.128 1.00 43.90 C ATOM 1080 NE ARG A 125 -23.838 -2.574 28.401 1.00 43.25 N ATOM 1081 CZ ARG A 125 -25.152 -2.607 28.583 1.00 39.62 C ATOM 1082 NH1 ARG A 125 -25.966 -2.366 27.551 1.00 39.07 N ATOM 1083 NH2 ARG A 125 -25.667 -2.927 29.795 1.00 36.79 N ATOM 1084 HE ARG A 125 -23.232 -2.803 29.215 1.00 0.00 H ATOM 1085 HH12 ARG A 125 -26.997 -2.390 27.685 1.00 0.00 H ATOM 1086 HH11 ARG A 125 -25.569 -2.154 26.614 1.00 0.00 H ATOM 1087 HH22 ARG A 125 -26.698 -2.951 29.932 1.00 0.00 H ATOM 1088 HH21 ARG A 125 -25.032 -3.148 30.588 1.00 0.00 H ATOM 1089 H ARG A 125 -20.893 -4.493 24.668 1.00 0.00 H ATOM 1090 N GLU A 126 -21.135 -7.044 28.189 1.00 39.80 N ATOM 1091 CA GLU A 126 -21.286 -8.454 28.536 1.00 41.71 C ATOM 1092 C GLU A 126 -22.493 -8.946 27.777 1.00 38.52 C ATOM 1093 O GLU A 126 -23.540 -8.291 27.859 1.00 37.26 O ATOM 1094 CB GLU A 126 -21.510 -8.583 30.063 1.00 46.81 C ATOM 1095 CG GLU A 126 -21.192 -9.955 30.614 1.00 56.38 C ATOM 1096 CD GLU A 126 -22.248 -10.980 30.245 1.00 52.63 C ATOM 1097 OE1 GLU A 126 -23.445 -10.629 30.341 1.00 54.75 O ATOM 1098 OE2 GLU A 126 -21.884 -12.122 29.857 1.00 51.16 O ATOM 1099 H GLU A 126 -21.261 -6.326 28.931 1.00 0.00 H ATOM 1100 N VAL A 127 -22.362 -10.050 27.022 1.00 41.44 N ATOM 1101 CA VAL A 127 -23.419 -10.428 26.080 1.00 36.56 C ATOM 1102 C VAL A 127 -24.726 -10.832 26.720 1.00 36.46 C ATOM 1103 O VAL A 127 -25.774 -10.597 26.134 1.00 37.02 O ATOM 1104 CB VAL A 127 -23.032 -11.520 24.988 1.00 37.29 C ATOM 1105 CG1 VAL A 127 -21.964 -11.042 24.093 1.00 38.92 C ATOM 1106 CG2 VAL A 127 -22.695 -12.848 25.603 1.00 46.17 C ATOM 1107 H VAL A 127 -21.508 -10.638 27.106 1.00 0.00 H ATOM 1108 N HIS A 128 -24.680 -11.492 27.882 1.00 34.78 N ATOM 1109 CA HIS A 128 -25.905 -11.893 28.557 1.00 33.49 C ATOM 1110 C HIS A 128 -26.705 -10.688 29.035 1.00 34.57 C ATOM 1111 O HIS A 128 -27.949 -10.635 28.879 1.00 33.49 O ATOM 1112 CB HIS A 128 -25.584 -12.836 29.749 1.00 39.77 C ATOM 1113 CG HIS A 128 -24.762 -14.033 29.364 1.00 55.28 C ATOM 1114 ND1 HIS A 128 -23.387 -14.069 29.497 1.00 61.23 N ATOM 1115 CD2 HIS A 128 -25.120 -15.229 28.833 1.00 62.09 C ATOM 1116 CE1 HIS A 128 -22.935 -15.236 29.070 1.00 58.65 C ATOM 1117 NE2 HIS A 128 -23.966 -15.959 28.663 1.00 62.82 N ATOM 1118 H HIS A 128 -23.759 -11.721 28.308 1.00 0.00 H ATOM 1119 N ILE A 129 -26.014 -9.676 29.554 1.00 33.69 N ATOM 1120 CA ILE A 129 -26.750 -8.467 29.956 1.00 30.42 C ATOM 1121 C ILE A 129 -27.340 -7.780 28.742 1.00 32.39 C ATOM 1122 O ILE A 129 -28.497 -7.385 28.764 1.00 33.20 O ATOM 1123 CB ILE A 129 -25.853 -7.477 30.709 1.00 32.71 C ATOM 1124 CG1 ILE A 129 -25.214 -8.172 31.920 1.00 36.82 C ATOM 1125 CG2 ILE A 129 -26.664 -6.225 31.160 1.00 37.56 C ATOM 1126 CD1 ILE A 129 -26.204 -8.724 32.847 1.00 37.69 C ATOM 1127 H ILE A 129 -24.983 -9.738 29.672 1.00 0.00 H ATOM 1128 N TYR A 130 -26.528 -7.629 27.687 1.00 34.15 N ATOM 1129 CA TYR A 130 -27.007 -6.957 26.486 1.00 35.15 C ATOM 1130 C TYR A 130 -28.224 -7.720 25.949 1.00 31.99 C ATOM 1131 O TYR A 130 -29.276 -7.124 25.623 1.00 33.22 O ATOM 1132 CB TYR A 130 -25.857 -6.811 25.470 1.00 38.53 C ATOM 1133 CG TYR A 130 -26.249 -6.009 24.266 1.00 35.03 C ATOM 1134 CD1 TYR A 130 -26.255 -4.627 24.293 1.00 47.02 C ATOM 1135 CD2 TYR A 130 -26.635 -6.639 23.108 1.00 36.37 C ATOM 1136 CE1 TYR A 130 -26.647 -3.905 23.190 1.00 48.61 C ATOM 1137 CE2 TYR A 130 -27.001 -5.939 22.010 1.00 44.12 C ATOM 1138 CZ TYR A 130 -27.028 -4.585 22.048 1.00 42.94 C ATOM 1139 OH TYR A 130 -27.437 -3.914 20.911 1.00 46.43 O ATOM 1140 HH TYR A 130 -27.409 -2.938 21.077 1.00 0.00 H ATOM 1141 H TYR A 130 -25.554 -7.992 27.725 1.00 0.00 H ATOM 1142 N TYR A 131 -28.146 -9.056 25.962 1.00 32.49 N ATOM 1143 CA TYR A 131 -29.277 -9.861 25.502 1.00 32.99 C ATOM 1144 C TYR A 131 -30.526 -9.551 26.338 1.00 36.19 C ATOM 1145 O TYR A 131 -31.634 -9.363 25.822 1.00 35.66 O ATOM 1146 CB TYR A 131 -28.932 -11.376 25.584 1.00 35.02 C ATOM 1147 CG TYR A 131 -30.127 -12.189 25.205 1.00 37.09 C ATOM 1148 CD1 TYR A 131 -31.104 -12.508 26.135 1.00 40.62 C ATOM 1149 CD2 TYR A 131 -30.320 -12.589 23.885 1.00 31.45 C ATOM 1150 CE1 TYR A 131 -32.268 -13.219 25.760 1.00 43.99 C ATOM 1151 CE2 TYR A 131 -31.483 -13.317 23.504 1.00 32.51 C ATOM 1152 CZ TYR A 131 -32.439 -13.621 24.443 1.00 47.08 C ATOM 1153 OH TYR A 131 -33.571 -14.336 24.061 1.00 41.96 O ATOM 1154 HH TYR A 131 -34.062 -13.828 23.367 1.00 0.00 H ATOM 1155 H TYR A 131 -27.280 -9.522 26.300 1.00 0.00 H ATOM 1156 N LEU A 132 -30.368 -9.528 27.654 1.00 35.13 N ATOM 1157 CA LEU A 132 -31.516 -9.276 28.508 1.00 35.92 C ATOM 1158 C LEU A 132 -32.114 -7.890 28.284 1.00 27.77 C ATOM 1159 O LEU A 132 -33.338 -7.731 28.321 1.00 37.66 O ATOM 1160 CB LEU A 132 -31.126 -9.435 29.986 1.00 39.08 C ATOM 1161 CG LEU A 132 -30.806 -10.845 30.453 1.00 39.39 C ATOM 1162 CD1 LEU A 132 -30.136 -10.809 31.860 1.00 41.65 C ATOM 1163 CD2 LEU A 132 -32.074 -11.734 30.450 1.00 43.57 C ATOM 1164 H LEU A 132 -29.429 -9.689 28.072 1.00 0.00 H ATOM 1165 N GLU A 133 -31.270 -6.887 28.071 1.00 34.67 N ATOM 1166 CA GLU A 133 -31.818 -5.564 27.783 1.00 39.63 C ATOM 1167 C GLU A 133 -32.572 -5.543 26.453 1.00 44.87 C ATOM 1168 O GLU A 133 -33.635 -4.932 26.329 1.00 36.06 O ATOM 1169 CB GLU A 133 -30.707 -4.541 27.755 1.00 36.06 C ATOM 1170 CG GLU A 133 -30.100 -4.330 29.166 1.00 48.94 C ATOM 1171 CD GLU A 133 -28.990 -3.303 29.197 1.00 50.15 C ATOM 1172 OE1 GLU A 133 -28.480 -2.947 28.117 1.00 53.47 O ATOM 1173 OE2 GLU A 133 -28.619 -2.856 30.309 1.00 44.52 O ATOM 1174 H GLU A 133 -30.242 -7.040 28.108 1.00 0.00 H ATOM 1175 N LYS A 134 -32.021 -6.194 25.435 1.00 38.73 N ATOM 1176 CA LYS A 134 -32.756 -6.289 24.148 1.00 39.91 C ATOM 1177 C LYS A 134 -34.117 -6.978 24.306 1.00 36.51 C ATOM 1178 O LYS A 134 -35.162 -6.488 23.823 1.00 46.30 O ATOM 1179 CB LYS A 134 -31.908 -7.031 23.106 1.00 37.37 C ATOM 1180 CG LYS A 134 -30.796 -6.201 22.529 1.00 51.58 C ATOM 1181 CD LYS A 134 -31.356 -5.225 21.492 1.00 54.27 C ATOM 1182 CE LYS A 134 -30.287 -4.925 20.500 1.00 43.48 C ATOM 1183 NZ LYS A 134 -30.604 -3.908 19.539 1.00 40.73 N ATOM 1184 HZ1 LYS A 134 -31.440 -4.198 18.992 1.00 0.00 H ATOM 1185 HZ2 LYS A 134 -30.805 -3.016 20.034 1.00 0.00 H ATOM 1186 HZ3 LYS A 134 -29.797 -3.776 18.897 1.00 0.00 H ATOM 1187 H LYS A 134 -31.084 -6.633 25.538 1.00 0.00 H ATOM 1188 N ALA A 135 -34.118 -8.104 25.010 1.00 33.72 N ATOM 1189 CA ALA A 135 -35.341 -8.888 25.177 1.00 36.64 C ATOM 1190 C ALA A 135 -36.353 -8.093 25.980 1.00 53.19 C ATOM 1191 O ALA A 135 -37.564 -8.237 25.793 1.00 54.25 O ATOM 1192 CB ALA A 135 -35.072 -10.212 25.862 1.00 40.63 C ATOM 1193 H ALA A 135 -33.235 -8.433 25.450 1.00 0.00 H ATOM 1194 N ASN A 136 -35.860 -7.262 26.888 1.00 44.27 N ATOM 1195 CA ASN A 136 -36.783 -6.533 27.740 1.00 51.56 C ATOM 1196 C ASN A 136 -37.360 -5.384 26.959 1.00 54.37 C ATOM 1197 O ASN A 136 -38.477 -4.938 27.220 1.00 58.59 O ATOM 1198 CB ASN A 136 -36.070 -6.017 28.980 1.00 46.67 C ATOM 1199 CG ASN A 136 -36.997 -5.235 29.899 1.00 56.32 C ATOM 1200 OD1 ASN A 136 -37.942 -5.791 30.469 1.00 51.82 O ATOM 1201 ND2 ASN A 136 -36.731 -3.951 30.039 1.00 47.66 N ATOM 1202 HD22 ASN A 136 -35.923 -3.530 29.537 1.00 0.00 H ATOM 1203 HD21 ASN A 136 -37.329 -3.360 30.651 1.00 0.00 H ATOM 1204 H ASN A 136 -34.833 -7.135 26.988 1.00 0.00 H ATOM 1205 N LYS A 137 -36.590 -4.909 25.984 1.00 49.07 N ATOM 1206 CA LYS A 137 -37.012 -3.775 25.190 1.00 54.10 C ATOM 1207 C LYS A 137 -38.092 -4.154 24.187 1.00 65.45 C ATOM 1208 O LYS A 137 -39.066 -3.414 24.006 1.00 57.79 O ATOM 1209 CB LYS A 137 -35.804 -3.137 24.494 1.00 54.68 C ATOM 1210 CG LYS A 137 -36.136 -2.115 23.412 1.00 63.42 C ATOM 1211 CD LYS A 137 -36.959 -0.971 23.971 1.00 76.13 C ATOM 1212 CE LYS A 137 -36.576 0.356 23.323 1.00 75.87 C ATOM 1213 NZ LYS A 137 -36.621 0.263 21.835 1.00 70.97 N ATOM 1214 HZ1 LYS A 137 -35.954 -0.468 21.514 1.00 0.00 H ATOM 1215 HZ2 LYS A 137 -37.584 0.012 21.534 1.00 0.00 H ATOM 1216 HZ3 LYS A 137 -36.356 1.180 21.423 1.00 0.00 H ATOM 1217 H LYS A 137 -35.673 -5.358 25.790 1.00 0.00 H ATOM 1218 N ILE A 138 -37.952 -5.305 23.537 1.00 56.07 N ATOM 1219 CA ILE A 138 -38.858 -5.562 22.406 1.00 64.02 C ATOM 1220 C ILE A 138 -40.143 -6.341 22.750 1.00 70.87 C ATOM 1221 O ILE A 138 -41.153 -6.272 22.019 1.00 67.42 O ATOM 1222 CB ILE A 138 -38.126 -6.234 21.234 1.00 55.38 C ATOM 1223 CG1 ILE A 138 -37.769 -7.685 21.581 1.00 51.82 C ATOM 1224 CG2 ILE A 138 -36.897 -5.417 20.838 1.00 50.26 C ATOM 1225 CD1 ILE A 138 -37.150 -8.438 20.381 1.00 52.67 C ATOM 1226 H ILE A 138 -37.229 -5.998 23.817 1.00 0.00 H ATOM 1227 N LYS A 139 -40.091 -7.110 23.834 1.00 64.53 N ATOM 1228 CA LYS A 139 -41.310 -7.655 24.439 1.00 73.77 C ATOM 1229 C LYS A 139 -42.142 -8.589 23.543 1.00 80.01 C ATOM 1230 O LYS A 139 -43.351 -8.738 23.750 1.00 78.35 O ATOM 1231 CB LYS A 139 -42.187 -6.505 24.951 1.00 70.87 C ATOM 1232 CG LYS A 139 -41.850 -6.029 26.360 1.00 75.76 C ATOM 1233 CD LYS A 139 -42.211 -4.558 26.538 1.00 72.51 C ATOM 1234 CE LYS A 139 -42.287 -4.173 28.007 1.00 75.93 C ATOM 1235 NZ LYS A 139 -40.970 -4.272 28.709 1.00 65.49 N ATOM 1236 HZ1 LYS A 139 -40.624 -5.251 28.657 1.00 0.00 H ATOM 1237 HZ2 LYS A 139 -40.286 -3.636 28.251 1.00 0.00 H ATOM 1238 HZ3 LYS A 139 -41.088 -3.997 29.705 1.00 0.00 H ATOM 1239 H LYS A 139 -39.168 -7.329 24.260 1.00 0.00 H ATOM 1240 N SER A 140 -41.506 -9.211 22.552 1.00 75.47 N ATOM 1241 CA SER A 140 -42.172 -10.257 21.779 1.00 60.07 C ATOM 1242 C SER A 140 -41.682 -11.621 22.210 1.00 67.99 C ATOM 1243 O SER A 140 -40.535 -11.778 22.621 1.00 74.80 O ATOM 1244 CB SER A 140 -41.912 -10.098 20.282 1.00 68.86 C ATOM 1245 OG SER A 140 -42.513 -11.165 19.551 1.00 64.40 O ATOM 1246 HG SER A 140 -42.333 -11.044 18.585 1.00 0.00 H ATOM 1247 H SER A 140 -40.525 -8.950 22.326 1.00 0.00 H ATOM 1248 N GLU A 141 -42.555 -12.615 22.119 1.00 76.14 N ATOM 1249 CA GLU A 141 -42.121 -13.997 22.263 1.00 75.09 C ATOM 1250 C GLU A 141 -41.917 -14.584 20.870 1.00 74.16 C ATOM 1251 O GLU A 141 -41.641 -15.788 20.717 1.00 74.17 O ATOM 1252 CB GLU A 141 -43.122 -14.826 23.083 1.00 82.75 C ATOM 1253 CG GLU A 141 -43.196 -14.443 24.584 1.00 95.47 C ATOM 1254 CD GLU A 141 -41.818 -14.345 25.268 1.00 94.54 C ATOM 1255 OE1 GLU A 141 -41.341 -15.364 25.822 1.00 96.07 O ATOM 1256 OE2 GLU A 141 -41.221 -13.242 25.269 1.00 87.78 O ATOM 1257 H GLU A 141 -43.558 -12.405 21.943 1.00 0.00 H ATOM 1258 N LYS A 142 -42.051 -13.723 19.858 1.00 65.88 N ATOM 1259 CA LYS A 142 -41.883 -14.144 18.470 1.00 61.49 C ATOM 1260 C LYS A 142 -40.517 -13.764 17.904 1.00 46.84 C ATOM 1261 O LYS A 142 -39.808 -14.647 17.370 1.00 46.65 O ATOM 1262 CB LYS A 142 -43.003 -13.594 17.573 1.00 66.81 C ATOM 1263 CG LYS A 142 -44.398 -14.097 17.924 1.00 69.85 C ATOM 1264 CD LYS A 142 -44.478 -15.621 17.863 1.00 81.16 C ATOM 1265 CE LYS A 142 -45.424 -16.157 18.939 1.00 77.97 C ATOM 1266 NZ LYS A 142 -46.758 -15.447 18.939 1.00 71.91 N ATOM 1267 HZ1 LYS A 142 -46.610 -14.433 19.117 1.00 0.00 H ATOM 1268 HZ2 LYS A 142 -47.217 -15.574 18.015 1.00 0.00 H ATOM 1269 HZ3 LYS A 142 -47.362 -15.847 19.685 1.00 0.00 H ATOM 1270 H LYS A 142 -42.280 -12.730 20.063 1.00 0.00 H ATOM 1271 N THR A 143 -40.151 -12.478 18.015 1.00 43.20 N ATOM 1272 CA THR A 143 -38.895 -11.973 17.427 1.00 38.91 C ATOM 1273 C THR A 143 -37.661 -12.649 18.048 1.00 43.56 C ATOM 1274 O THR A 143 -37.480 -12.670 19.273 1.00 38.46 O ATOM 1275 CB THR A 143 -38.759 -10.448 17.576 1.00 41.97 C ATOM 1276 OG1 THR A 143 -39.808 -9.812 16.866 1.00 46.97 O ATOM 1277 CG2 THR A 143 -37.425 -9.929 16.999 1.00 36.59 C ATOM 1278 HG1 THR A 143 -39.722 -8.830 16.961 1.00 0.00 H ATOM 1279 H THR A 143 -40.769 -11.819 18.530 1.00 0.00 H ATOM 1280 N HIS A 144 -36.797 -13.178 17.192 1.00 35.97 N ATOM 1281 CA HIS A 144 -35.629 -13.922 17.631 1.00 32.70 C ATOM 1282 C HIS A 144 -34.475 -12.942 17.794 1.00 32.77 C ATOM 1283 O HIS A 144 -34.232 -12.135 16.930 1.00 34.90 O ATOM 1284 CB HIS A 144 -35.278 -14.984 16.566 1.00 32.05 C ATOM 1285 CG HIS A 144 -34.526 -16.174 17.093 1.00 32.87 C ATOM 1286 ND1 HIS A 144 -35.153 -17.212 17.739 1.00 33.08 N ATOM 1287 CD2 HIS A 144 -33.217 -16.511 17.024 1.00 30.36 C ATOM 1288 CE1 HIS A 144 -34.260 -18.125 18.078 1.00 40.00 C ATOM 1289 NE2 HIS A 144 -33.074 -17.721 17.658 1.00 34.16 N ATOM 1290 H HIS A 144 -36.961 -13.056 16.172 1.00 0.00 H ATOM 1291 N ILE A 145 -33.710 -13.044 18.876 1.00 29.77 N ATOM 1292 CA ILE A 145 -32.596 -12.144 19.075 1.00 27.18 C ATOM 1293 C ILE A 145 -31.247 -12.850 18.925 1.00 27.05 C ATOM 1294 O ILE A 145 -31.068 -13.944 19.444 1.00 29.51 O ATOM 1295 CB ILE A 145 -32.652 -11.519 20.503 1.00 31.73 C ATOM 1296 CG1 ILE A 145 -33.917 -10.659 20.640 1.00 32.95 C ATOM 1297 CG2 ILE A 145 -31.424 -10.635 20.761 1.00 32.14 C ATOM 1298 CD1 ILE A 145 -34.343 -10.502 22.109 1.00 34.21 C ATOM 1299 H ILE A 145 -33.914 -13.777 19.585 1.00 0.00 H ATOM 1300 N HIS A 146 -30.311 -12.244 18.188 1.00 27.39 N ATOM 1301 CA HIS A 146 -28.984 -12.863 18.002 1.00 29.49 C ATOM 1302 C HIS A 146 -28.007 -11.760 18.269 1.00 26.85 C ATOM 1303 O HIS A 146 -27.984 -10.777 17.563 1.00 30.38 O ATOM 1304 CB HIS A 146 -28.790 -13.455 16.592 1.00 26.67 C ATOM 1305 CG HIS A 146 -27.626 -14.392 16.471 1.00 30.29 C ATOM 1306 ND1 HIS A 146 -27.704 -15.579 15.774 1.00 32.12 N ATOM 1307 CD2 HIS A 146 -26.359 -14.335 16.974 1.00 29.68 C ATOM 1308 CE1 HIS A 146 -26.541 -16.221 15.857 1.00 29.68 C ATOM 1309 NE2 HIS A 146 -25.708 -15.485 16.573 1.00 27.93 N ATOM 1310 H HIS A 146 -30.520 -11.328 17.742 1.00 0.00 H ATOM 1311 N ILE A 147 -27.229 -11.928 19.324 1.00 29.14 N ATOM 1312 CA ILE A 147 -26.172 -10.995 19.716 1.00 28.30 C ATOM 1313 C ILE A 147 -24.774 -11.502 19.380 1.00 29.27 C ATOM 1314 O ILE A 147 -24.423 -12.672 19.687 1.00 30.50 O ATOM 1315 CB ILE A 147 -26.208 -10.770 21.275 1.00 27.38 C ATOM 1316 CG1 ILE A 147 -27.604 -10.349 21.761 1.00 30.42 C ATOM 1317 CG2 ILE A 147 -25.077 -9.802 21.695 1.00 31.34 C ATOM 1318 CD1 ILE A 147 -28.211 -9.167 20.974 1.00 29.78 C ATOM 1319 H ILE A 147 -27.377 -12.774 19.911 1.00 0.00 H ATOM 1320 N PHE A 148 -23.966 -10.619 18.784 1.00 27.02 N ATOM 1321 CA PHE A 148 -22.533 -10.846 18.543 1.00 26.58 C ATOM 1322 C PHE A 148 -21.713 -9.832 19.363 1.00 35.49 C ATOM 1323 O PHE A 148 -21.977 -8.617 19.359 1.00 30.06 O ATOM 1324 CB PHE A 148 -22.179 -10.648 17.082 1.00 26.79 C ATOM 1325 CG PHE A 148 -22.871 -11.606 16.145 1.00 30.99 C ATOM 1326 CD1 PHE A 148 -24.126 -11.308 15.610 1.00 26.66 C ATOM 1327 CD2 PHE A 148 -22.256 -12.805 15.810 1.00 32.27 C ATOM 1328 CE1 PHE A 148 -24.740 -12.188 14.707 1.00 30.10 C ATOM 1329 CE2 PHE A 148 -22.861 -13.686 14.930 1.00 29.50 C ATOM 1330 CZ PHE A 148 -24.105 -13.386 14.386 1.00 30.57 C ATOM 1331 H PHE A 148 -24.376 -9.716 18.472 1.00 0.00 H ATOM 1332 N SER A 149 -20.694 -10.335 20.029 1.00 30.12 N ATOM 1333 CA SER A 149 -19.724 -9.453 20.679 1.00 33.23 C ATOM 1334 C SER A 149 -18.470 -9.384 19.839 1.00 36.84 C ATOM 1335 O SER A 149 -18.154 -10.317 19.084 1.00 35.62 O ATOM 1336 CB SER A 149 -19.351 -10.001 22.053 1.00 39.20 C ATOM 1337 OG SER A 149 -18.234 -9.275 22.577 1.00 43.30 O ATOM 1338 HG SER A 149 -17.997 -9.635 23.468 1.00 0.00 H ATOM 1339 H SER A 149 -20.578 -11.367 20.093 1.00 0.00 H ATOM 1340 N PHE A 150 -17.713 -8.302 19.979 1.00 36.02 N ATOM 1341 CA PHE A 150 -16.421 -8.254 19.343 1.00 34.47 C ATOM 1342 C PHE A 150 -15.456 -9.257 20.018 1.00 38.06 C ATOM 1343 O PHE A 150 -14.375 -9.493 19.474 1.00 47.46 O ATOM 1344 CB PHE A 150 -15.770 -6.859 19.423 1.00 35.16 C ATOM 1345 CG PHE A 150 -16.368 -5.830 18.500 1.00 33.81 C ATOM 1346 CD1 PHE A 150 -17.497 -5.106 18.877 1.00 32.98 C ATOM 1347 CD2 PHE A 150 -15.806 -5.573 17.282 1.00 30.62 C ATOM 1348 CE1 PHE A 150 -18.018 -4.147 18.036 1.00 29.04 C ATOM 1349 CE2 PHE A 150 -16.343 -4.620 16.442 1.00 34.52 C ATOM 1350 CZ PHE A 150 -17.447 -3.919 16.838 1.00 30.31 C ATOM 1351 H PHE A 150 -18.050 -7.496 20.543 1.00 0.00 H ATOM 1352 N THR A 151 -15.810 -9.815 21.179 1.00 41.71 N ATOM 1353 CA THR A 151 -14.972 -10.885 21.772 1.00 46.73 C ATOM 1354 C THR A 151 -15.136 -12.235 21.052 1.00 49.27 C ATOM 1355 O THR A 151 -14.349 -13.164 21.264 1.00 40.79 O ATOM 1356 CB THR A 151 -15.247 -11.103 23.273 1.00 46.56 C ATOM 1357 OG1 THR A 151 -16.494 -11.783 23.441 1.00 42.86 O ATOM 1358 CG2 THR A 151 -15.307 -9.769 24.045 1.00 39.28 C ATOM 1359 HG1 THR A 151 -16.666 -11.921 24.406 1.00 0.00 H ATOM 1360 H THR A 151 -16.673 -9.499 21.667 1.00 0.00 H ATOM 1361 N GLY A 152 -16.143 -12.358 20.192 1.00 37.84 N ATOM 1362 CA GLY A 152 -16.382 -13.621 19.507 1.00 37.69 C ATOM 1363 C GLY A 152 -17.496 -14.329 20.251 1.00 35.64 C ATOM 1364 O GLY A 152 -17.997 -15.371 19.832 1.00 33.37 O ATOM 1365 H GLY A 152 -16.765 -11.545 20.007 1.00 0.00 H ATOM 1366 N GLU A 153 -17.907 -13.782 21.375 1.00 31.88 N ATOM 1367 CA GLU A 153 -18.995 -14.431 22.114 1.00 34.95 C ATOM 1368 C GLU A 153 -20.311 -14.174 21.404 1.00 36.59 C ATOM 1369 O GLU A 153 -20.396 -13.238 20.642 1.00 36.78 O ATOM 1370 CB GLU A 153 -19.107 -13.851 23.508 1.00 41.78 C ATOM 1371 CG GLU A 153 -18.168 -14.451 24.489 1.00 55.21 C ATOM 1372 CD GLU A 153 -18.207 -13.673 25.783 1.00 76.25 C ATOM 1373 OE1 GLU A 153 -17.463 -12.665 25.855 1.00 74.50 O ATOM 1374 OE2 GLU A 153 -18.998 -14.044 26.694 1.00 67.98 O ATOM 1375 H GLU A 153 -17.470 -12.908 21.732 1.00 0.00 H ATOM 1376 N GLU A 154 -21.326 -14.989 21.643 1.00 28.90 N ATOM 1377 CA GLU A 154 -22.612 -14.707 21.024 1.00 35.58 C ATOM 1378 C GLU A 154 -23.682 -15.274 21.914 1.00 33.35 C ATOM 1379 O GLU A 154 -23.392 -16.072 22.797 1.00 33.02 O ATOM 1380 CB GLU A 154 -22.671 -15.211 19.556 1.00 40.56 C ATOM 1381 CG GLU A 154 -22.655 -16.659 19.424 1.00 43.32 C ATOM 1382 CD GLU A 154 -22.452 -17.157 17.985 1.00 45.36 C ATOM 1383 OE1 GLU A 154 -21.563 -17.990 17.820 1.00 42.08 O ATOM 1384 OE2 GLU A 154 -23.213 -16.793 17.050 1.00 37.62 O ATOM 1385 H GLU A 154 -21.206 -15.816 22.262 1.00 0.00 H ATOM 1386 N MET A 155 -24.918 -14.826 21.730 1.00 28.05 N ATOM 1387 CA MET A 155 -26.024 -15.273 22.560 1.00 29.04 C ATOM 1388 C MET A 155 -27.250 -15.170 21.699 1.00 31.13 C ATOM 1389 O MET A 155 -27.410 -14.209 20.986 1.00 34.32 O ATOM 1390 CB MET A 155 -26.165 -14.306 23.765 1.00 32.22 C ATOM 1391 CG MET A 155 -27.369 -14.554 24.589 1.00 43.12 C ATOM 1392 SD MET A 155 -27.336 -16.240 25.226 1.00 57.43 S ATOM 1393 CE MET A 155 -28.924 -16.182 26.095 1.00 71.21 C ATOM 1394 H MET A 155 -25.100 -14.137 20.972 1.00 0.00 H ATOM 1395 N ALA A 156 -28.117 -16.162 21.727 1.00 29.15 N ATOM 1396 CA ALA A 156 -29.287 -16.108 20.870 1.00 28.69 C ATOM 1397 C ALA A 156 -30.461 -16.744 21.573 1.00 33.81 C ATOM 1398 O ALA A 156 -30.285 -17.657 22.397 1.00 36.92 O ATOM 1399 CB ALA A 156 -29.016 -16.837 19.555 1.00 32.14 C ATOM 1400 H ALA A 156 -27.964 -16.975 22.357 1.00 0.00 H ATOM 1401 N THR A 157 -31.652 -16.312 21.183 1.00 32.37 N ATOM 1402 CA THR A 157 -32.904 -16.779 21.753 1.00 34.59 C ATOM 1403 C THR A 157 -32.996 -18.301 21.710 1.00 36.83 C ATOM 1404 O THR A 157 -32.791 -18.920 20.653 1.00 37.12 O ATOM 1405 CB THR A 157 -34.072 -16.166 20.967 1.00 35.43 C ATOM 1406 OG1 THR A 157 -33.992 -14.739 21.054 1.00 32.85 O ATOM 1407 CG2 THR A 157 -35.421 -16.639 21.511 1.00 36.62 C ATOM 1408 HG1 THR A 157 -34.046 -14.464 22.003 1.00 0.00 H ATOM 1409 H THR A 157 -31.692 -15.599 20.427 1.00 0.00 H ATOM 1410 N LYS A 158 -33.225 -18.886 22.887 1.00 39.90 N ATOM 1411 CA LYS A 158 -33.443 -20.311 23.043 1.00 32.94 C ATOM 1412 C LYS A 158 -32.267 -21.145 22.573 1.00 36.43 C ATOM 1413 O LYS A 158 -32.464 -22.278 22.136 1.00 38.63 O ATOM 1414 CB LYS A 158 -34.697 -20.740 22.270 1.00 37.32 C ATOM 1415 CG LYS A 158 -36.005 -20.295 22.962 1.00 42.15 C ATOM 1416 CD LYS A 158 -37.217 -20.514 22.046 1.00 51.40 C ATOM 1417 CE LYS A 158 -38.540 -20.255 22.777 1.00 61.10 C ATOM 1418 NZ LYS A 158 -38.700 -18.827 23.182 1.00 64.55 N ATOM 1419 HZ1 LYS A 158 -37.923 -18.560 23.820 1.00 0.00 H ATOM 1420 HZ2 LYS A 158 -38.678 -18.223 22.335 1.00 0.00 H ATOM 1421 HZ3 LYS A 158 -39.610 -18.707 23.672 1.00 0.00 H ATOM 1422 H LYS A 158 -33.248 -18.288 23.738 1.00 0.00 H ATOM 1423 N ALA A 159 -31.060 -20.597 22.662 1.00 30.20 N ATOM 1424 CA ALA A 159 -29.854 -21.274 22.175 1.00 36.72 C ATOM 1425 C ALA A 159 -29.992 -21.776 20.736 1.00 34.03 C ATOM 1426 O ALA A 159 -29.340 -22.756 20.321 1.00 38.44 O ATOM 1427 CB ALA A 159 -29.448 -22.426 23.128 1.00 38.73 C ATOM 1428 H ALA A 159 -30.967 -19.655 23.092 1.00 0.00 H ATOM 1429 N ASP A 160 -30.827 -21.092 19.954 1.00 34.49 N ATOM 1430 CA ASP A 160 -30.950 -21.382 18.537 1.00 35.08 C ATOM 1431 C ASP A 160 -30.198 -20.313 17.715 1.00 36.10 C ATOM 1432 O ASP A 160 -30.647 -19.166 17.611 1.00 33.39 O ATOM 1433 CB ASP A 160 -32.434 -21.448 18.176 1.00 32.91 C ATOM 1434 CG ASP A 160 -32.677 -21.634 16.703 1.00 31.76 C ATOM 1435 OD1 ASP A 160 -31.698 -21.839 15.918 1.00 40.67 O ATOM 1436 OD2 ASP A 160 -33.854 -21.563 16.320 1.00 43.97 O ATOM 1437 H ASP A 160 -31.404 -20.333 20.369 1.00 0.00 H ATOM 1438 N TYR A 161 -29.079 -20.700 17.116 1.00 28.47 N ATOM 1439 CA TYR A 161 -28.148 -19.756 16.498 1.00 33.57 C ATOM 1440 C TYR A 161 -28.430 -19.490 15.023 1.00 32.97 C ATOM 1441 O TYR A 161 -27.746 -18.681 14.378 1.00 30.87 O ATOM 1442 CB TYR A 161 -26.676 -20.174 16.801 1.00 31.42 C ATOM 1443 CG TYR A 161 -26.402 -19.867 18.265 1.00 31.66 C ATOM 1444 CD1 TYR A 161 -26.777 -20.776 19.290 1.00 40.45 C ATOM 1445 CD2 TYR A 161 -25.882 -18.634 18.641 1.00 33.59 C ATOM 1446 CE1 TYR A 161 -26.581 -20.450 20.668 1.00 37.91 C ATOM 1447 CE2 TYR A 161 -25.682 -18.304 19.979 1.00 39.42 C ATOM 1448 CZ TYR A 161 -26.036 -19.200 20.983 1.00 37.82 C ATOM 1449 OH TYR A 161 -25.848 -18.809 22.296 1.00 39.89 O ATOM 1450 HH TYR A 161 -26.139 -19.537 22.901 1.00 0.00 H ATOM 1451 H TYR A 161 -28.855 -21.715 17.085 1.00 0.00 H ATOM 1452 N THR A 162 -29.449 -20.165 14.488 1.00 29.56 N ATOM 1453 CA THR A 162 -29.941 -19.928 13.125 1.00 33.39 C ATOM 1454 C THR A 162 -29.016 -20.346 11.979 1.00 33.48 C ATOM 1455 O THR A 162 -29.397 -21.181 11.148 1.00 33.62 O ATOM 1456 CB THR A 162 -30.411 -18.450 12.936 1.00 31.79 C ATOM 1457 OG1 THR A 162 -31.436 -18.181 13.913 1.00 32.75 O ATOM 1458 CG2 THR A 162 -30.968 -18.249 11.523 1.00 34.73 C ATOM 1459 HG1 THR A 162 -31.066 -18.309 14.822 1.00 0.00 H ATOM 1460 H THR A 162 -29.917 -20.894 15.064 1.00 0.00 H ATOM 1461 N LEU A 163 -27.835 -19.743 11.897 1.00 32.54 N ATOM 1462 CA LEU A 163 -26.859 -20.067 10.878 1.00 29.13 C ATOM 1463 C LEU A 163 -25.880 -21.085 11.404 1.00 31.12 C ATOM 1464 O LEU A 163 -25.719 -21.241 12.627 1.00 30.43 O ATOM 1465 CB LEU A 163 -26.061 -18.816 10.486 1.00 25.73 C ATOM 1466 CG LEU A 163 -26.881 -17.598 10.041 1.00 34.85 C ATOM 1467 CD1 LEU A 163 -25.998 -16.350 9.831 1.00 28.12 C ATOM 1468 CD2 LEU A 163 -27.670 -17.953 8.769 1.00 35.35 C ATOM 1469 H LEU A 163 -27.602 -19.007 12.594 1.00 0.00 H ATOM 1470 N ASP A 164 -25.157 -21.729 10.492 1.00 36.31 N ATOM 1471 CA ASP A 164 -24.158 -22.716 10.897 1.00 34.90 C ATOM 1472 C ASP A 164 -22.854 -22.080 11.351 1.00 40.17 C ATOM 1473 O ASP A 164 -22.662 -20.880 11.218 1.00 32.11 O ATOM 1474 CB ASP A 164 -23.953 -23.771 9.792 1.00 36.63 C ATOM 1475 CG ASP A 164 -23.221 -23.246 8.582 1.00 44.95 C ATOM 1476 OD1 ASP A 164 -22.562 -22.193 8.626 1.00 41.52 O ATOM 1477 OD2 ASP A 164 -23.279 -23.921 7.535 1.00 57.91 O ATOM 1478 H ASP A 164 -25.304 -21.529 9.482 1.00 0.00 H ATOM 1479 N GLU A 165 -21.951 -22.880 11.897 1.00 33.54 N ATOM 1480 CA GLU A 165 -20.788 -22.335 12.569 1.00 33.41 C ATOM 1481 C GLU A 165 -19.866 -21.592 11.659 1.00 40.67 C ATOM 1482 O GLU A 165 -19.235 -20.638 12.096 1.00 34.39 O ATOM 1483 CB GLU A 165 -19.980 -23.421 13.303 1.00 38.41 C ATOM 1484 CG GLU A 165 -20.735 -24.004 14.448 1.00 45.10 C ATOM 1485 CD GLU A 165 -20.746 -23.090 15.661 1.00 37.30 C ATOM 1486 OE1 GLU A 165 -19.758 -22.355 15.891 1.00 37.71 O ATOM 1487 OE2 GLU A 165 -21.747 -23.122 16.390 1.00 41.29 O ATOM 1488 H GLU A 165 -22.078 -23.911 11.843 1.00 0.00 H ATOM 1489 N GLU A 166 -19.724 -22.018 10.416 1.00 32.39 N ATOM 1490 CA GLU A 166 -18.798 -21.284 9.589 1.00 35.14 C ATOM 1491 C GLU A 166 -19.370 -19.918 9.130 1.00 32.39 C ATOM 1492 O GLU A 166 -18.596 -18.978 8.952 1.00 37.24 O ATOM 1493 CB GLU A 166 -18.265 -22.149 8.421 1.00 45.57 C ATOM 1494 CG GLU A 166 -17.456 -23.439 8.921 1.00 56.30 C ATOM 1495 CD GLU A 166 -16.131 -23.142 9.689 1.00 56.76 C ATOM 1496 OE1 GLU A 166 -15.577 -22.023 9.582 1.00 59.01 O ATOM 1497 OE2 GLU A 166 -15.631 -24.051 10.388 1.00 56.14 O ATOM 1498 H GLU A 166 -20.251 -22.838 10.054 1.00 0.00 H ATOM 1499 N SER A 167 -20.695 -19.805 8.961 1.00 35.75 N ATOM 1500 CA SER A 167 -21.313 -18.500 8.588 1.00 36.37 C ATOM 1501 C SER A 167 -21.085 -17.513 9.739 1.00 32.84 C ATOM 1502 O SER A 167 -20.641 -16.351 9.551 1.00 32.23 O ATOM 1503 CB SER A 167 -22.830 -18.638 8.354 1.00 35.71 C ATOM 1504 OG SER A 167 -23.088 -19.550 7.309 1.00 44.08 O ATOM 1505 HG SER A 167 -22.717 -20.436 7.547 1.00 0.00 H ATOM 1506 H SER A 167 -21.301 -20.640 9.092 1.00 0.00 H ATOM 1507 N ARG A 168 -21.361 -18.007 10.948 1.00 31.36 N ATOM 1508 CA ARG A 168 -21.156 -17.192 12.148 1.00 33.52 C ATOM 1509 C ARG A 168 -19.700 -16.861 12.363 1.00 35.52 C ATOM 1510 O ARG A 168 -19.371 -15.742 12.766 1.00 32.37 O ATOM 1511 CB ARG A 168 -21.825 -17.822 13.364 1.00 31.12 C ATOM 1512 CG ARG A 168 -23.322 -17.805 13.138 1.00 34.01 C ATOM 1513 CD ARG A 168 -24.150 -18.618 14.057 1.00 32.01 C ATOM 1514 NE ARG A 168 -23.466 -18.994 15.279 1.00 33.39 N ATOM 1515 CZ ARG A 168 -23.298 -20.261 15.641 1.00 37.65 C ATOM 1516 NH1 ARG A 168 -23.782 -21.246 14.871 1.00 32.60 N ATOM 1517 NH2 ARG A 168 -22.663 -20.541 16.759 1.00 32.09 N ATOM 1518 HE ARG A 168 -23.093 -18.244 15.895 1.00 0.00 H ATOM 1519 HH12 ARG A 168 -23.651 -22.238 15.153 1.00 0.00 H ATOM 1520 HH11 ARG A 168 -24.288 -21.018 13.992 1.00 0.00 H ATOM 1521 HH22 ARG A 168 -22.529 -21.531 17.047 1.00 0.00 H ATOM 1522 HH21 ARG A 168 -22.295 -19.772 17.355 1.00 0.00 H ATOM 1523 H ARG A 168 -21.724 -18.977 11.039 1.00 0.00 H ATOM 1524 N ALA A 169 -18.805 -17.802 12.052 1.00 33.09 N ATOM 1525 CA ALA A 169 -17.367 -17.543 12.169 1.00 37.85 C ATOM 1526 C ALA A 169 -16.907 -16.449 11.217 1.00 33.78 C ATOM 1527 O ALA A 169 -15.978 -15.683 11.552 1.00 34.79 O ATOM 1528 CB ALA A 169 -16.533 -18.859 11.927 1.00 35.65 C ATOM 1529 H ALA A 169 -19.133 -18.732 11.722 1.00 0.00 H ATOM 1530 N ARG A 170 -17.500 -16.398 10.027 1.00 34.97 N ATOM 1531 CA ARG A 170 -17.190 -15.294 9.087 1.00 34.51 C ATOM 1532 C ARG A 170 -17.542 -13.914 9.668 1.00 31.09 C ATOM 1533 O ARG A 170 -16.755 -12.925 9.537 1.00 33.48 O ATOM 1534 CB ARG A 170 -17.964 -15.488 7.775 1.00 35.45 C ATOM 1535 CG ARG A 170 -17.136 -16.191 6.649 1.00 53.70 C ATOM 1536 CD ARG A 170 -17.903 -16.322 5.310 1.00 50.06 C ATOM 1537 NE ARG A 170 -18.580 -17.609 5.162 1.00 57.36 N ATOM 1538 CZ ARG A 170 -19.910 -17.783 5.100 1.00 63.57 C ATOM 1539 NH1 ARG A 170 -20.753 -16.751 5.172 1.00 64.07 N ATOM 1540 NH2 ARG A 170 -20.415 -19.005 4.961 1.00 65.27 N ATOM 1541 HE ARG A 170 -17.983 -18.459 5.100 1.00 0.00 H ATOM 1542 HH12 ARG A 170 -21.779 -16.913 5.121 1.00 0.00 H ATOM 1543 HH11 ARG A 170 -20.384 -15.785 5.279 1.00 0.00 H ATOM 1544 HH22 ARG A 170 -21.445 -19.140 4.913 1.00 0.00 H ATOM 1545 HH21 ARG A 170 -19.780 -19.826 4.900 1.00 0.00 H ATOM 1546 H ARG A 170 -18.183 -17.134 9.756 1.00 0.00 H ATOM 1547 N ILE A 171 -18.748 -13.843 10.244 1.00 29.42 N ATOM 1548 CA ILE A 171 -19.171 -12.591 10.964 1.00 26.28 C ATOM 1549 C ILE A 171 -18.215 -12.240 12.098 1.00 34.77 C ATOM 1550 O ILE A 171 -17.746 -11.115 12.215 1.00 31.62 O ATOM 1551 CB ILE A 171 -20.621 -12.722 11.461 1.00 31.11 C ATOM 1552 CG1 ILE A 171 -21.551 -12.729 10.251 1.00 30.92 C ATOM 1553 CG2 ILE A 171 -20.978 -11.552 12.468 1.00 28.74 C ATOM 1554 CD1 ILE A 171 -22.963 -13.270 10.523 1.00 30.24 C ATOM 1555 H ILE A 171 -19.395 -14.656 10.194 1.00 0.00 H ATOM 1556 N LYS A 172 -17.897 -13.211 12.943 1.00 28.60 N ATOM 1557 CA LYS A 172 -16.995 -12.950 14.059 1.00 32.44 C ATOM 1558 C LYS A 172 -15.609 -12.523 13.658 1.00 30.93 C ATOM 1559 O LYS A 172 -15.001 -11.661 14.311 1.00 32.28 O ATOM 1560 CB LYS A 172 -16.891 -14.189 14.942 1.00 33.25 C ATOM 1561 CG LYS A 172 -18.137 -14.490 15.718 1.00 32.12 C ATOM 1562 CD LYS A 172 -17.903 -15.855 16.375 1.00 38.11 C ATOM 1563 CE LYS A 172 -19.129 -16.444 16.875 1.00 44.64 C ATOM 1564 NZ LYS A 172 -18.866 -17.910 17.052 1.00 50.13 N ATOM 1565 HZ1 LYS A 172 -18.603 -18.327 16.136 1.00 0.00 H ATOM 1566 HZ2 LYS A 172 -18.089 -18.042 17.731 1.00 0.00 H ATOM 1567 HZ3 LYS A 172 -19.725 -18.374 17.411 1.00 0.00 H ATOM 1568 H LYS A 172 -18.293 -14.163 12.809 1.00 0.00 H ATOM 1569 N THR A 173 -15.098 -13.128 12.589 1.00 29.33 N ATOM 1570 CA THR A 173 -13.810 -12.763 12.052 1.00 35.15 C ATOM 1571 C THR A 173 -13.835 -11.340 11.519 1.00 33.31 C ATOM 1572 O THR A 173 -12.863 -10.603 11.682 1.00 33.06 O ATOM 1573 CB THR A 173 -13.390 -13.701 10.898 1.00 36.49 C ATOM 1574 OG1 THR A 173 -13.242 -15.015 11.428 1.00 37.78 O ATOM 1575 CG2 THR A 173 -12.064 -13.256 10.288 1.00 37.17 C ATOM 1576 HG1 THR A 173 -14.104 -15.313 11.814 1.00 0.00 H ATOM 1577 H THR A 173 -15.642 -13.885 12.128 1.00 0.00 H ATOM 1578 N ARG A 174 -14.925 -10.955 10.872 1.00 29.72 N ATOM 1579 CA ARG A 174 -15.029 -9.563 10.404 1.00 30.08 C ATOM 1580 C ARG A 174 -14.993 -8.626 11.619 1.00 27.11 C ATOM 1581 O ARG A 174 -14.306 -7.575 11.619 1.00 30.60 O ATOM 1582 CB ARG A 174 -16.303 -9.391 9.569 1.00 29.60 C ATOM 1583 CG ARG A 174 -16.618 -7.939 9.119 1.00 34.06 C ATOM 1584 CD ARG A 174 -15.429 -7.353 8.281 1.00 36.63 C ATOM 1585 NE ARG A 174 -15.717 -5.969 7.885 1.00 38.96 N ATOM 1586 CZ ARG A 174 -14.804 -5.049 7.573 1.00 41.15 C ATOM 1587 NH1 ARG A 174 -13.494 -5.343 7.566 1.00 38.58 N ATOM 1588 NH2 ARG A 174 -15.211 -3.821 7.255 1.00 41.31 N ATOM 1589 HE ARG A 174 -16.716 -5.683 7.845 1.00 0.00 H ATOM 1590 HH12 ARG A 174 -12.798 -4.611 7.320 1.00 0.00 H ATOM 1591 HH11 ARG A 174 -13.175 -6.303 7.807 1.00 0.00 H ATOM 1592 HH22 ARG A 174 -14.514 -3.090 7.009 1.00 0.00 H ATOM 1593 HH21 ARG A 174 -16.226 -3.594 7.253 1.00 0.00 H ATOM 1594 H ARG A 174 -15.698 -11.628 10.697 1.00 0.00 H ATOM 1595 N LEU A 175 -15.698 -8.993 12.677 1.00 28.26 N ATOM 1596 CA LEU A 175 -15.682 -8.159 13.891 1.00 32.69 C ATOM 1597 C LEU A 175 -14.309 -8.056 14.505 1.00 36.29 C ATOM 1598 O LEU A 175 -13.863 -6.965 14.955 1.00 31.56 O ATOM 1599 CB LEU A 175 -16.714 -8.642 14.922 1.00 30.76 C ATOM 1600 CG LEU A 175 -18.178 -8.484 14.550 1.00 33.42 C ATOM 1601 CD1 LEU A 175 -19.001 -9.148 15.652 1.00 32.46 C ATOM 1602 CD2 LEU A 175 -18.626 -6.991 14.286 1.00 27.29 C ATOM 1603 H LEU A 175 -16.261 -9.867 12.651 1.00 0.00 H ATOM 1604 N PHE A 176 -13.583 -9.178 14.540 1.00 30.73 N ATOM 1605 CA PHE A 176 -12.210 -9.106 15.059 1.00 28.52 C ATOM 1606 C PHE A 176 -11.347 -8.218 14.197 1.00 30.15 C ATOM 1607 O PHE A 176 -10.510 -7.491 14.712 1.00 36.09 O ATOM 1608 CB PHE A 176 -11.541 -10.506 15.032 1.00 39.96 C ATOM 1609 CG PHE A 176 -12.012 -11.417 16.089 1.00 41.26 C ATOM 1610 CD1 PHE A 176 -13.116 -11.105 16.866 1.00 53.42 C ATOM 1611 CD2 PHE A 176 -11.339 -12.605 16.335 1.00 60.19 C ATOM 1612 CE1 PHE A 176 -13.553 -11.973 17.866 1.00 51.95 C ATOM 1613 CE2 PHE A 176 -11.770 -13.473 17.337 1.00 60.17 C ATOM 1614 CZ PHE A 176 -12.875 -13.151 18.103 1.00 53.58 C ATOM 1615 H PHE A 176 -13.980 -10.080 14.208 1.00 0.00 H ATOM 1616 N THR A 177 -11.487 -8.338 12.879 1.00 31.09 N ATOM 1617 CA THR A 177 -10.710 -7.505 11.953 1.00 35.96 C ATOM 1618 C THR A 177 -10.959 -5.999 12.190 1.00 35.49 C ATOM 1619 O THR A 177 -10.029 -5.185 12.208 1.00 34.38 O ATOM 1620 CB THR A 177 -11.043 -7.893 10.506 1.00 40.08 C ATOM 1621 OG1 THR A 177 -10.624 -9.249 10.310 1.00 42.86 O ATOM 1622 CG2 THR A 177 -10.309 -7.001 9.503 1.00 45.77 C ATOM 1623 HG1 THR A 177 -11.106 -9.837 10.944 1.00 0.00 H ATOM 1624 H THR A 177 -12.159 -9.034 12.498 1.00 0.00 H ATOM 1625 N ILE A 178 -12.219 -5.639 12.391 1.00 34.12 N ATOM 1626 CA ILE A 178 -12.568 -4.235 12.636 1.00 34.21 C ATOM 1627 C ILE A 178 -11.920 -3.769 13.918 1.00 33.58 C ATOM 1628 O ILE A 178 -11.297 -2.688 13.985 1.00 32.39 O ATOM 1629 CB ILE A 178 -14.077 -4.089 12.737 1.00 30.26 C ATOM 1630 CG1 ILE A 178 -14.694 -4.261 11.351 1.00 27.16 C ATOM 1631 CG2 ILE A 178 -14.462 -2.697 13.382 1.00 33.76 C ATOM 1632 CD1 ILE A 178 -16.246 -4.511 11.396 1.00 30.63 C ATOM 1633 H ILE A 178 -12.969 -6.360 12.375 1.00 0.00 H ATOM 1634 N ARG A 179 -12.066 -4.582 14.952 1.00 31.85 N ATOM 1635 CA ARG A 179 -11.475 -4.271 16.232 1.00 35.18 C ATOM 1636 C ARG A 179 -9.948 -4.087 16.113 1.00 35.87 C ATOM 1637 O ARG A 179 -9.351 -3.131 16.679 1.00 31.93 O ATOM 1638 CB ARG A 179 -11.867 -5.412 17.157 1.00 35.34 C ATOM 1639 CG ARG A 179 -11.895 -5.123 18.570 1.00 48.05 C ATOM 1640 CD ARG A 179 -10.652 -5.480 19.146 1.00 46.81 C ATOM 1641 NE ARG A 179 -10.824 -6.464 20.193 1.00 60.83 N ATOM 1642 CZ ARG A 179 -9.918 -6.633 21.153 1.00 73.20 C ATOM 1643 NH1 ARG A 179 -10.092 -7.538 22.108 1.00 76.74 N ATOM 1644 NH2 ARG A 179 -8.835 -5.856 21.175 1.00 75.30 N ATOM 1645 HE ARG A 179 -11.679 -7.056 20.195 1.00 0.00 H ATOM 1646 HH12 ARG A 179 -9.373 -7.656 22.850 1.00 0.00 H ATOM 1647 HH11 ARG A 179 -10.947 -8.129 22.114 1.00 0.00 H ATOM 1648 HH22 ARG A 179 -8.121 -5.980 21.921 1.00 0.00 H ATOM 1649 HH21 ARG A 179 -8.704 -5.126 20.446 1.00 0.00 H ATOM 1650 H ARG A 179 -12.615 -5.458 14.841 1.00 0.00 H ATOM 1651 N GLN A 180 -9.307 -4.977 15.364 1.00 33.25 N ATOM 1652 CA GLN A 180 -7.840 -4.974 15.214 1.00 40.64 C ATOM 1653 C GLN A 180 -7.364 -3.736 14.443 1.00 36.51 C ATOM 1654 O GLN A 180 -6.364 -3.085 14.793 1.00 36.42 O ATOM 1655 CB GLN A 180 -7.437 -6.264 14.457 1.00 40.17 C ATOM 1656 CG GLN A 180 -6.008 -6.361 13.977 1.00 53.30 C ATOM 1657 CD GLN A 180 -5.643 -7.800 13.538 1.00 73.14 C ATOM 1658 OE1 GLN A 180 -5.983 -8.235 12.433 1.00 61.53 O ATOM 1659 NE2 GLN A 180 -4.962 -8.537 14.418 1.00 70.67 N ATOM 1660 HE22 GLN A 180 -4.695 -8.133 15.338 1.00 0.00 H ATOM 1661 HE21 GLN A 180 -4.699 -9.515 14.183 1.00 0.00 H ATOM 1662 H GLN A 180 -9.860 -5.703 14.865 1.00 0.00 H ATOM 1663 N GLU A 181 -8.065 -3.413 13.375 1.00 34.34 N ATOM 1664 CA GLU A 181 -7.702 -2.224 12.601 1.00 37.14 C ATOM 1665 C GLU A 181 -7.974 -0.934 13.388 1.00 35.40 C ATOM 1666 O GLU A 181 -7.165 0.008 13.332 1.00 41.29 O ATOM 1667 CB GLU A 181 -8.418 -2.195 11.258 1.00 39.20 C ATOM 1668 CG GLU A 181 -8.287 -3.486 10.447 1.00 53.00 C ATOM 1669 CD GLU A 181 -7.213 -3.388 9.372 1.00 76.40 C ATOM 1670 OE1 GLU A 181 -6.285 -2.541 9.540 1.00 67.21 O ATOM 1671 OE2 GLU A 181 -7.314 -4.151 8.368 1.00 72.11 O ATOM 1672 H GLU A 181 -8.872 -4.000 13.083 1.00 0.00 H ATOM 1673 N MET A 182 -9.088 -0.886 14.125 1.00 34.81 N ATOM 1674 CA MET A 182 -9.309 0.232 15.033 1.00 34.85 C ATOM 1675 C MET A 182 -8.167 0.389 16.030 1.00 41.42 C ATOM 1676 O MET A 182 -7.662 1.505 16.267 1.00 36.18 O ATOM 1677 CB MET A 182 -10.610 0.116 15.790 1.00 31.64 C ATOM 1678 CG MET A 182 -11.854 0.403 14.936 1.00 31.64 C ATOM 1679 SD MET A 182 -13.297 0.378 16.006 1.00 32.03 S ATOM 1680 CE MET A 182 -14.628 0.699 14.828 1.00 28.44 C ATOM 1681 H MET A 182 -9.795 -1.645 14.051 1.00 0.00 H ATOM 1682 N ALA A 183 -7.745 -0.722 16.623 1.00 35.86 N ATOM 1683 CA ALA A 183 -6.718 -0.670 17.650 1.00 38.16 C ATOM 1684 C ALA A 183 -5.411 -0.198 17.046 1.00 37.05 C ATOM 1685 O ALA A 183 -4.686 0.554 17.676 1.00 39.65 O ATOM 1686 CB ALA A 183 -6.538 -2.048 18.322 1.00 37.61 C ATOM 1687 H ALA A 183 -8.154 -1.638 16.350 1.00 0.00 H ATOM 1688 N SER A 184 -5.100 -0.623 15.834 1.00 36.08 N ATOM 1689 CA SER A 184 -3.811 -0.216 15.287 1.00 49.38 C ATOM 1690 C SER A 184 -3.869 1.249 14.921 1.00 52.60 C ATOM 1691 O SER A 184 -2.815 1.906 14.784 1.00 43.45 O ATOM 1692 CB SER A 184 -3.368 -1.076 14.098 1.00 42.76 C ATOM 1693 OG SER A 184 -4.369 -1.142 13.114 1.00 56.35 O ATOM 1694 HG SER A 184 -5.187 -1.540 13.504 1.00 0.00 H ATOM 1695 H SER A 184 -5.750 -1.225 15.290 1.00 0.00 H ATOM 1696 N ARG A 185 -5.086 1.784 14.774 1.00 44.49 N ATOM 1697 CA ARG A 185 -5.161 3.230 14.555 1.00 43.74 C ATOM 1698 C ARG A 185 -5.343 4.079 15.812 1.00 40.42 C ATOM 1699 O ARG A 185 -5.435 5.308 15.711 1.00 41.01 O ATOM 1700 CB ARG A 185 -6.210 3.556 13.501 1.00 37.01 C ATOM 1701 CG ARG A 185 -5.914 2.899 12.157 1.00 38.37 C ATOM 1702 CD ARG A 185 -7.094 3.130 11.214 1.00 43.06 C ATOM 1703 NE ARG A 185 -6.988 2.434 9.933 1.00 45.25 N ATOM 1704 CZ ARG A 185 -7.279 2.993 8.758 1.00 61.93 C ATOM 1705 NH1 ARG A 185 -7.650 4.283 8.678 1.00 49.52 N ATOM 1706 NH2 ARG A 185 -7.186 2.269 7.648 1.00 57.87 N ATOM 1707 HE ARG A 185 -6.667 1.445 9.938 1.00 0.00 H ATOM 1708 HH12 ARG A 185 -7.874 4.703 7.753 1.00 0.00 H ATOM 1709 HH11 ARG A 185 -7.713 4.860 9.541 1.00 0.00 H ATOM 1710 HH22 ARG A 185 -7.411 2.697 6.727 1.00 0.00 H ATOM 1711 HH21 ARG A 185 -6.888 1.274 7.700 1.00 0.00 H ATOM 1712 H ARG A 185 -5.944 1.197 14.814 1.00 0.00 H ATOM 1713 N GLY A 186 -5.358 3.450 16.999 1.00 37.70 N ATOM 1714 CA GLY A 186 -5.629 4.136 18.258 1.00 32.34 C ATOM 1715 C GLY A 186 -7.090 4.492 18.457 1.00 39.18 C ATOM 1716 O GLY A 186 -7.408 5.324 19.307 1.00 40.83 O ATOM 1717 H GLY A 186 -5.168 2.428 17.022 1.00 0.00 H ATOM 1718 N LEU A 187 -7.983 3.849 17.698 1.00 33.03 N ATOM 1719 CA LEU A 187 -9.405 4.215 17.683 1.00 32.84 C ATOM 1720 C LEU A 187 -10.283 3.326 18.569 1.00 34.87 C ATOM 1721 O LEU A 187 -11.433 3.674 18.924 1.00 34.42 O ATOM 1722 CB LEU A 187 -9.912 4.170 16.231 1.00 35.08 C ATOM 1723 CG LEU A 187 -9.274 5.105 15.214 1.00 37.98 C ATOM 1724 CD1 LEU A 187 -9.676 4.643 13.835 1.00 36.34 C ATOM 1725 CD2 LEU A 187 -9.705 6.544 15.436 1.00 37.16 C ATOM 1726 H LEU A 187 -7.660 3.063 17.098 1.00 0.00 H ATOM 1727 N TRP A 188 -9.748 2.172 18.944 1.00 35.47 N ATOM 1728 CA TRP A 188 -10.552 1.162 19.641 1.00 35.03 C ATOM 1729 C TRP A 188 -10.999 1.594 21.011 1.00 33.45 C ATOM 1730 O TRP A 188 -12.185 1.408 21.387 1.00 32.95 O ATOM 1731 CB TRP A 188 -9.803 -0.210 19.680 1.00 33.67 C ATOM 1732 CG TRP A 188 -10.550 -1.245 20.515 1.00 35.01 C ATOM 1733 CD1 TRP A 188 -10.157 -1.766 21.734 1.00 40.02 C ATOM 1734 CD2 TRP A 188 -11.811 -1.869 20.195 1.00 33.02 C ATOM 1735 NE1 TRP A 188 -11.113 -2.660 22.192 1.00 37.39 N ATOM 1736 CE2 TRP A 188 -12.121 -2.763 21.259 1.00 40.71 C ATOM 1737 CE3 TRP A 188 -12.719 -1.739 19.131 1.00 30.37 C ATOM 1738 CZ2 TRP A 188 -13.291 -3.530 21.283 1.00 35.81 C ATOM 1739 CZ3 TRP A 188 -13.894 -2.550 19.144 1.00 32.71 C ATOM 1740 CH2 TRP A 188 -14.170 -3.400 20.230 1.00 31.97 C ATOM 1741 HE1 TRP A 188 -11.075 -3.172 23.097 1.00 0.00 H ATOM 1742 H TRP A 188 -8.746 1.981 18.741 1.00 0.00 H ATOM 1743 N ASP A 189 -10.083 2.137 21.823 1.00 35.70 N ATOM 1744 CA ASP A 189 -10.481 2.478 23.200 1.00 38.73 C ATOM 1745 C ASP A 189 -11.698 3.404 23.238 1.00 32.30 C ATOM 1746 O ASP A 189 -12.658 3.200 24.012 1.00 35.41 O ATOM 1747 CB ASP A 189 -9.334 3.138 23.979 1.00 41.76 C ATOM 1748 CG ASP A 189 -8.184 2.160 24.282 1.00 63.63 C ATOM 1749 OD1 ASP A 189 -8.448 0.952 24.482 1.00 57.10 O ATOM 1750 OD2 ASP A 189 -7.009 2.606 24.323 1.00 70.65 O ATOM 1751 H ASP A 189 -9.114 2.314 21.490 1.00 0.00 H ATOM 1752 N SER A 190 -11.660 4.444 22.417 1.00 35.48 N ATOM 1753 CA SER A 190 -12.765 5.407 22.454 1.00 32.05 C ATOM 1754 C SER A 190 -14.064 4.785 21.898 1.00 34.99 C ATOM 1755 O SER A 190 -15.165 4.989 22.452 1.00 33.91 O ATOM 1756 CB SER A 190 -12.372 6.624 21.619 1.00 34.99 C ATOM 1757 OG SER A 190 -13.437 7.561 21.576 1.00 34.48 O ATOM 1758 HG SER A 190 -13.652 7.857 22.496 1.00 0.00 H ATOM 1759 H SER A 190 -10.864 4.574 21.761 1.00 0.00 H ATOM 1760 N PHE A 191 -13.925 3.998 20.837 1.00 33.30 N ATOM 1761 CA PHE A 191 -15.072 3.352 20.199 1.00 32.43 C ATOM 1762 C PHE A 191 -15.772 2.440 21.185 1.00 30.53 C ATOM 1763 O PHE A 191 -16.997 2.471 21.406 1.00 33.95 O ATOM 1764 CB PHE A 191 -14.589 2.493 19.028 1.00 27.08 C ATOM 1765 CG PHE A 191 -15.705 1.720 18.368 1.00 31.36 C ATOM 1766 CD1 PHE A 191 -16.706 2.385 17.711 1.00 30.86 C ATOM 1767 CD2 PHE A 191 -15.771 0.324 18.468 1.00 32.44 C ATOM 1768 CE1 PHE A 191 -17.773 1.682 17.089 1.00 35.14 C ATOM 1769 CE2 PHE A 191 -16.801 -0.388 17.869 1.00 28.61 C ATOM 1770 CZ PHE A 191 -17.826 0.296 17.187 1.00 36.69 C ATOM 1771 H PHE A 191 -12.974 3.837 20.449 1.00 0.00 H ATOM 1772 N ARG A 192 -14.978 1.577 21.800 1.00 36.05 N ATOM 1773 CA ARG A 192 -15.496 0.705 22.833 1.00 30.31 C ATOM 1774 C ARG A 192 -16.178 1.445 23.964 1.00 37.82 C ATOM 1775 O ARG A 192 -17.265 1.028 24.405 1.00 37.05 O ATOM 1776 CB ARG A 192 -14.344 -0.120 23.430 1.00 38.52 C ATOM 1777 CG ARG A 192 -14.804 -0.920 24.619 1.00 48.93 C ATOM 1778 CD ARG A 192 -13.691 -1.774 25.257 1.00 42.59 C ATOM 1779 NE ARG A 192 -14.249 -2.459 26.421 1.00 45.80 N ATOM 1780 CZ ARG A 192 -13.658 -3.477 27.039 1.00 56.16 C ATOM 1781 NH1 ARG A 192 -12.498 -3.946 26.589 1.00 56.99 N ATOM 1782 NH2 ARG A 192 -14.248 -4.043 28.094 1.00 59.17 N ATOM 1783 HE ARG A 192 -15.165 -2.130 26.788 1.00 0.00 H ATOM 1784 HH12 ARG A 192 -12.036 -4.742 27.073 1.00 0.00 H ATOM 1785 HH11 ARG A 192 -12.053 -3.516 25.753 1.00 0.00 H ATOM 1786 HH22 ARG A 192 -13.790 -4.840 28.581 1.00 0.00 H ATOM 1787 HH21 ARG A 192 -15.166 -3.687 28.429 1.00 0.00 H ATOM 1788 H ARG A 192 -13.973 1.525 21.538 1.00 0.00 H ATOM 1789 N GLN A 193 -15.549 2.522 24.466 1.00 40.75 N ATOM 1790 CA GLN A 193 -16.185 3.320 25.545 1.00 36.80 C ATOM 1791 C GLN A 193 -17.475 4.031 25.149 1.00 37.02 C ATOM 1792 O GLN A 193 -18.343 4.263 26.004 1.00 39.25 O ATOM 1793 CB GLN A 193 -15.209 4.355 26.100 1.00 43.18 C ATOM 1794 CG GLN A 193 -13.985 3.695 26.752 1.00 51.18 C ATOM 1795 CD GLN A 193 -14.347 2.817 27.938 1.00 67.39 C ATOM 1796 OE1 GLN A 193 -14.749 1.652 27.771 1.00 66.11 O ATOM 1797 NE2 GLN A 193 -14.188 3.358 29.149 1.00 73.53 N ATOM 1798 HE22 GLN A 193 -13.849 4.337 29.241 1.00 0.00 H ATOM 1799 HE21 GLN A 193 -14.403 2.800 30.000 1.00 0.00 H ATOM 1800 H GLN A 193 -14.616 2.797 24.098 1.00 0.00 H ATOM 1801 N SER A 194 -17.618 4.340 23.865 1.00 40.00 N ATOM 1802 CA SER A 194 -18.789 5.060 23.352 1.00 39.68 C ATOM 1803 C SER A 194 -20.116 4.280 23.427 1.00 45.03 C ATOM 1804 O SER A 194 -21.189 4.886 23.317 1.00 39.88 O ATOM 1805 CB SER A 194 -18.538 5.518 21.905 1.00 40.70 C ATOM 1806 OG SER A 194 -18.716 4.442 20.977 1.00 36.58 O ATOM 1807 HG SER A 194 -18.080 3.714 21.191 1.00 0.00 H ATOM 1808 H SER A 194 -16.871 4.061 23.197 1.00 0.00 H ATOM 1809 N GLU A 195 -20.071 2.955 23.612 1.00 36.18 N ATOM 1810 CA GLU A 195 -21.311 2.180 23.615 1.00 40.60 C ATOM 1811 C GLU A 195 -22.284 2.624 24.713 1.00 45.82 C ATOM 1812 O GLU A 195 -21.892 2.728 25.871 1.00 44.81 O ATOM 1813 CB GLU A 195 -21.045 0.656 23.714 1.00 37.54 C ATOM 1814 CG GLU A 195 -22.331 -0.143 23.578 1.00 36.73 C ATOM 1815 CD GLU A 195 -22.125 -1.657 23.484 1.00 42.24 C ATOM 1816 OE1 GLU A 195 -20.957 -2.127 23.496 1.00 38.33 O ATOM 1817 OE2 GLU A 195 -23.153 -2.366 23.410 1.00 40.16 O ATOM 1818 H GLU A 195 -19.157 2.478 23.753 1.00 0.00 H ATOM 1819 N ARG A 196 -23.538 2.854 24.309 1.00 45.01 N ATOM 1820 CA ARG A 196 -24.607 3.462 25.094 1.00 57.85 C ATOM 1821 C ARG A 196 -24.409 4.971 25.313 1.00 70.50 C ATOM 1822 O ARG A 196 -24.772 5.794 24.456 1.00 72.25 O ATOM 1823 CB ARG A 196 -24.800 2.743 26.408 1.00 57.64 C ATOM 1824 CG ARG A 196 -25.674 1.535 26.346 1.00 54.78 C ATOM 1825 CD ARG A 196 -26.118 1.285 27.789 1.00 58.88 C ATOM 1826 NE ARG A 196 -27.388 0.581 27.910 1.00 62.79 N ATOM 1827 CZ ARG A 196 -28.564 1.173 27.773 1.00 48.64 C ATOM 1828 NH1 ARG A 196 -28.591 2.465 27.483 1.00 55.39 N ATOM 1829 NH2 ARG A 196 -29.699 0.480 27.886 1.00 48.48 N ATOM 1830 HE ARG A 196 -27.370 -0.439 28.114 1.00 0.00 H ATOM 1831 HH12 ARG A 196 -29.502 2.954 27.370 1.00 0.00 H ATOM 1832 HH11 ARG A 196 -27.701 2.991 27.368 1.00 0.00 H ATOM 1833 HH22 ARG A 196 -30.615 0.960 27.776 1.00 0.00 H ATOM 1834 HH21 ARG A 196 -29.668 -0.540 28.084 1.00 0.00 H ATOM 1835 H ARG A 196 -23.775 2.571 23.337 1.00 0.00 H TER 1836 ARG A 196 HETATM 1837 MN MN A 1 -30.165 -4.488 15.612 1.00 37.27 MN HETATM 1838 MN MN A 2 -32.379 -2.358 13.573 1.00 32.46 MN HETATM 1839 O HOH 3 -21.333 8.287 0.925 1.00 62.24 O HETATM 1840 O HOH 4 -40.458 -17.416 22.927 1.00 76.05 O HETATM 1841 O HOH 5 -46.895 0.632 6.956 1.00 57.74 O HETATM 1842 O HOH 6 -20.809 -0.799 -2.819 1.00 58.51 O HETATM 1843 O HOH 7 -26.563 10.653 2.713 1.00 65.79 O HETATM 1844 O HOH 8 -24.936 13.102 9.547 1.00 54.29 O HETATM 1845 O HOH 9 -24.592 2.315 22.001 1.00 51.57 O HETATM 1846 O HOH 10 -32.551 6.083 5.812 1.00 52.92 O HETATM 1847 O HOH 11 -31.245 2.115 28.862 1.00 59.94 O HETATM 1848 O HOH 12 -5.981 0.199 9.820 1.00 54.05 O HETATM 1849 O HOH 13 -9.236 5.791 20.892 1.00 37.91 O HETATM 1850 O HOH 14 -40.211 -16.649 27.620 1.00 67.38 O HETATM 1851 O HOH 15 -5.734 3.796 22.550 1.00 58.27 O HETATM 1852 O HOH 16 -42.630 -17.028 6.807 1.00 47.60 O HETATM 1853 O HOH 17 -12.396 10.783 5.706 1.00 53.77 O HETATM 1854 O HOH 18 -40.091 -7.532 17.884 1.00 62.72 O HETATM 1855 O HOH 19 -30.300 -17.052 15.850 1.00 33.24 O HETATM 1856 O HOH 20 -36.050 -5.379 17.240 1.00 45.88 O HETATM 1857 O HOH 21 -21.785 19.742 10.026 1.00 56.67 O HETATM 1858 O HOH 22 -32.404 -24.614 9.616 1.00 57.91 O HETATM 1859 O HOH 23 -24.675 8.247 23.789 1.00 58.40 O HETATM 1860 O HOH 24 -31.199 -19.474 0.792 1.00 61.14 O HETATM 1861 O HOH 25 -18.507 -8.808 25.097 1.00 38.20 O HETATM 1862 O HOH 26 -19.006 -17.738 19.626 1.00 54.65 O HETATM 1863 O HOH 27 -28.575 -10.577 1.429 1.00 47.53 O HETATM 1864 O HOH 28 -15.947 7.001 23.909 1.00 51.90 O HETATM 1865 O HOH 29 -35.211 2.812 1.952 1.00 44.42 O HETATM 1866 O HOH 30 -50.024 -10.294 11.170 1.00 58.16 O HETATM 1867 O HOH 31 -38.776 -9.681 23.952 1.00 60.76 O HETATM 1868 O HOH 32 -9.490 9.407 16.783 1.00 53.51 O HETATM 1869 O HOH 33 -37.594 -11.340 -0.945 1.00 50.30 O HETATM 1870 O HOH 34 -37.670 -17.004 18.516 1.00 46.95 O HETATM 1871 O HOH 35 -33.716 -3.199 14.656 1.00 33.08 O HETATM 1872 O HOH 36 -26.352 -20.642 24.141 1.00 44.27 O HETATM 1873 O HOH 37 -25.118 11.599 7.592 1.00 53.67 O HETATM 1874 O HOH 38 -29.012 -22.374 8.795 1.00 44.00 O HETATM 1875 O HOH 39 0.174 6.874 20.742 1.00 65.30 O HETATM 1876 O HOH 40 -18.646 -20.014 15.246 1.00 47.89 O HETATM 1877 O HOH 41 -35.884 -22.953 15.167 1.00 48.94 O HETATM 1878 O HOH 42 -30.527 -24.991 19.437 1.00 48.42 O HETATM 1879 O HOH 43 -7.840 6.307 10.438 1.00 48.46 O HETATM 1880 O HOH 44 -19.302 -12.661 18.251 1.00 39.43 O HETATM 1881 O HOH 45 -14.899 -12.570 7.619 1.00 42.75 O HETATM 1882 O HOH 46 -17.657 -3.477 3.961 1.00 45.26 O HETATM 1883 O HOH 47 -44.890 -9.678 1.395 1.00 39.88 O HETATM 1884 O HOH 48 -28.878 1.139 10.046 1.00 49.84 O HETATM 1885 O HOH 49 -34.235 -7.690 1.404 1.00 35.11 O HETATM 1886 O HOH 50 -10.169 -0.760 25.745 1.00 61.03 O HETATM 1887 O HOH 51 -18.704 -1.414 24.877 1.00 38.81 O HETATM 1888 O HOH 52 -34.006 -17.230 12.785 1.00 33.00 O HETATM 1889 O HOH 53 -16.382 3.419 1.685 1.00 40.00 O HETATM 1890 O HOH 54 -21.686 7.541 23.824 1.00 48.04 O HETATM 1891 O HOH 55 -22.005 -13.980 5.063 1.00 43.40 O HETATM 1892 O HOH 56 -6.545 8.964 10.118 1.00 44.70 O HETATM 1893 O HOH 57 -34.090 -2.035 12.115 1.00 35.18 O HETATM 1894 O HOH 58 -30.751 4.313 5.272 1.00 50.72 O HETATM 1895 O HOH 59 -47.199 -2.660 3.407 1.00 47.72 O HETATM 1896 O HOH 60 -12.508 6.139 18.270 1.00 30.05 O HETATM 1897 O HOH 61 -25.584 -1.505 24.948 1.00 41.17 O HETATM 1898 O HOH 62 -48.031 -6.046 0.753 1.00 52.22 O HETATM 1899 O HOH 63 -22.966 -19.596 4.023 1.00 55.45 O HETATM 1900 O HOH 64 -30.674 -24.943 8.178 1.00 65.40 O HETATM 1901 O HOH 65 -24.721 -1.914 21.154 1.00 44.39 O HETATM 1902 O HOH 66 -35.077 -9.582 29.476 1.00 39.70 O HETATM 1903 O HOH 67 -20.268 5.717 0.216 1.00 46.69 O HETATM 1904 O HOH 68 -46.930 0.893 11.428 1.00 62.43 O HETATM 1905 O HOH 69 -27.075 -0.233 11.521 1.00 33.99 O HETATM 1906 O HOH 70 -17.435 -8.650 4.917 1.00 57.22 O HETATM 1907 O HOH 71 -39.334 -19.570 16.187 1.00 50.95 O HETATM 1908 O HOH 72 -15.044 13.355 11.526 1.00 45.30 O HETATM 1909 O HOH 73 -30.598 -21.834 4.981 1.00 49.21 O HETATM 1910 O HOH 74 -32.820 -22.237 13.355 1.00 43.04 O HETATM 1911 O HOH 75 -34.343 -3.021 28.835 1.00 65.95 O HETATM 1912 O HOH 76 -6.786 -4.030 21.874 1.00 60.42 O HETATM 1913 O HOH 77 -5.592 5.844 21.418 1.00 48.07 O HETATM 1914 O HOH 78 -41.713 -6.375 19.241 1.00 58.59 O HETATM 1915 O HOH 79 -13.894 6.090 28.428 1.00 61.45 O HETATM 1916 O HOH 80 -38.452 -5.940 16.891 1.00 43.16 O HETATM 1917 O HOH 81 -19.540 -11.060 26.985 1.00 62.93 O HETATM 1918 O HOH 82 -43.537 -10.734 25.788 1.00 71.10 O HETATM 1919 O HOH 83 -32.502 -10.816 0.602 1.00 59.83 O HETATM 1920 O HOH 84 -32.001 -22.411 11.053 1.00 37.94 O HETATM 1921 O HOH 85 -41.282 -12.746 14.664 1.00 37.23 O HETATM 1922 O HOH 86 -20.133 -5.197 30.166 1.00 57.58 O HETATM 1923 O HOH 87 -31.119 -13.758 2.572 1.00 33.58 O HETATM 1924 O HOH 88 -34.605 -11.531 -1.344 1.00 54.85 O HETATM 1925 O HOH 89 -34.750 0.277 8.694 1.00 40.02 O HETATM 1926 O HOH 90 -12.580 -8.021 6.887 1.00 46.51 O HETATM 1927 O HOH 91 -18.447 14.086 5.847 1.00 56.66 O HETATM 1928 O HOH 92 -27.813 -1.106 21.630 1.00 53.10 O HETATM 1929 O HOH 93 -6.244 8.763 6.786 1.00 59.46 O HETATM 1930 O HOH 94 -43.496 1.686 0.381 1.00 52.07 O HETATM 1931 O HOH 95 -15.743 -19.344 8.370 1.00 52.60 O HETATM 1932 O HOH 96 -15.811 -23.305 13.229 1.00 54.55 O HETATM 1933 O HOH 97 -43.070 -11.755 2.106 1.00 46.34 O HETATM 1934 O HOH 98 -35.836 0.059 0.778 1.00 45.80 O HETATM 1935 O HOH 99 -39.158 -21.513 13.640 1.00 54.53 O HETATM 1936 O HOH 100 -45.017 3.024 6.568 1.00 47.77 O HETATM 1937 O HOH 101 -13.202 11.432 12.639 1.00 42.34 O HETATM 1938 O HOH 102 -13.398 8.505 24.405 1.00 48.82 O HETATM 1939 O HOH 103 -13.728 0.605 1.091 1.00 61.93 O HETATM 1940 O HOH 104 -49.407 -5.260 10.001 1.00 63.33 O HETATM 1941 O HOH 105 -9.563 -8.193 17.458 1.00 48.58 O HETATM 1942 O HOH 106 -24.616 -26.557 7.982 1.00 45.46 O HETATM 1943 O HOH 107 -42.512 4.834 13.847 1.00 70.52 O HETATM 1944 O HOH 108 -7.246 2.063 20.867 1.00 35.47 O HETATM 1945 O HOH 109 -45.431 -14.639 14.434 1.00 60.07 O HETATM 1946 O HOH 110 -22.922 -25.655 12.559 1.00 36.69 O HETATM 1947 O HOH 111 -20.466 -17.818 22.231 1.00 48.21 O HETATM 1948 O HOH 112 -22.018 -8.578 2.901 1.00 65.12 O HETATM 1949 O HOH 113 -50.389 -2.617 10.962 1.00 67.31 O HETATM 1950 O HOH 114 -9.207 12.881 5.243 1.00 63.89 O HETATM 1951 O HOH 115 -11.311 -9.388 19.555 1.00 59.74 O HETATM 1952 O HOH 116 -16.971 7.857 1.561 1.00 47.70 O HETATM 1953 O HOH 117 -4.222 -4.342 16.627 1.00 55.17 O HETATM 1954 O HOH 118 -34.089 -17.485 25.505 1.00 52.15 O HETATM 1955 O HOH 119 -35.841 -21.331 18.701 1.00 50.93 O HETATM 1956 O HOH 120 -33.502 15.413 9.436 1.00 64.62 O HETATM 1957 O HOH 121 -30.806 -1.951 3.421 1.00 50.74 O HETATM 1958 O HOH 122 -40.908 -17.515 16.697 1.00 58.79 O HETATM 1959 O HOH 123 -31.453 -1.407 21.294 1.00 65.26 O HETATM 1960 O HOH 124 -41.186 -23.586 10.641 1.00 64.01 O HETATM 1961 O HOH 125 -32.790 4.448 8.822 1.00 56.11 O HETATM 1962 O HOH 126 -49.614 0.743 8.729 1.00 62.87 O HETATM 1963 O HOH 127 -38.146 8.607 14.045 1.00 67.11 O HETATM 1964 O HOH 128 -31.922 10.623 4.897 1.00 51.73 O HETATM 1965 O HOH 129 -19.443 -7.996 3.705 1.00 64.44 O HETATM 1966 O HOH 130 -30.207 -18.811 25.398 1.00 59.40 O HETATM 1967 O HOH 131 -31.824 4.353 2.976 1.00 61.36 O HETATM 1968 O HOH 132 -25.891 -18.543 0.344 1.00 60.96 O HETATM 1969 O HOH 133 -34.334 0.458 11.293 1.00 44.52 O HETATM 1970 O HOH 134 -37.323 -12.278 23.057 1.00 68.32 O HETATM 1971 O HOH 135 -37.294 -25.241 9.354 1.00 64.37 O HETATM 1972 O HOH 136 -14.154 -7.538 29.496 1.00 69.22 O HETATM 1973 O HOH 137 -12.751 -10.254 7.967 1.00 44.12 O HETATM 1974 O HOH 138 -26.244 -21.541 7.340 1.00 43.79 O HETATM 1975 O HOH 139 -33.555 -2.341 19.517 1.00 64.66 O HETATM 1976 O HOH 140 -48.054 -0.275 5.109 1.00 55.05 O HETATM 1977 O HOH 141 -33.472 8.065 4.298 1.00 60.48 O HETATM 1978 O HOH 142 -14.215 -17.499 9.288 1.00 52.09 O HETATM 1979 O HOH 143 -17.564 -2.183 27.150 1.00 44.30 O HETATM 1980 O HOH 144 -7.510 -9.037 8.927 1.00 61.99 O HETATM 1981 O HOH 145 -3.583 5.983 12.547 1.00 44.59 O HETATM 1982 O HOH 146 -31.849 -0.209 1.865 1.00 56.77 O HETATM 1983 O HOH 147 -12.077 -6.316 29.527 1.00 68.93 O HETATM 1984 O HOH 148 -30.376 5.261 28.572 1.00 64.56 O HETATM 1985 O HOH 149 -29.573 -2.069 24.899 1.00 57.83 O HETATM 1986 O HOH 150 -11.490 13.888 9.285 1.00 54.25 O HETATM 1987 O HOH 151 -20.515 7.015 26.698 1.00 64.27 O HETATM 1988 O HOH 152 -42.851 3.975 2.104 1.00 53.72 O HETATM 1989 O HOH 153 -14.052 -1.355 1.146 1.00 57.70 O HETATM 1990 O HOH 154 -17.994 13.203 2.673 1.00 64.36 O HETATM 1991 O HOH 155 -39.097 -24.496 10.541 1.00 67.23 O HETATM 1992 O HOH 156 -26.198 -22.042 5.518 1.00 62.93 O HETATM 1993 O HOH 157 -3.216 0.766 10.043 1.00 60.97 O HETATM 1994 O HOH 158 -2.466 -2.518 17.898 1.00 51.96 O HETATM 1995 O HOH 159 -13.625 -15.452 7.415 1.00 57.46 O HETATM 1996 O HOH 160 -22.956 -3.650 -2.957 1.00 68.82 O HETATM 1997 O HOH 161 -17.661 -5.933 1.726 1.00 59.43 O HETATM 1998 O HOH 162 -17.738 5.306 0.559 1.00 47.98 O HETATM 1999 O HOH 163 -43.280 -14.399 1.369 1.00 54.82 O HETATM 2000 O HOH 164 -46.355 1.955 0.223 1.00 58.56 O HETATM 2001 O HOH 165 -8.289 -11.089 16.295 1.00 61.96 O HETATM 2002 O HOH 166 -45.716 -12.882 25.827 1.00 72.37 O HETATM 2003 O HOH 167 -40.194 -15.481 0.277 1.00 58.94 O HETATM 2004 O HOH 168 -50.909 -8.036 11.222 1.00 67.00 O HETATM 2005 O HOH 169 -46.545 4.221 4.712 1.00 59.66 O HETATM 2006 O HOH 170 -29.483 -26.214 23.483 1.00 62.31 O HETATM 2007 O HOH 171 -30.900 -3.796 1.807 1.00 58.66 O HETATM 2008 O HOH 172 -16.299 5.742 -2.146 1.00 57.21 O HETATM 2009 CAO UNN A 173 -35.998 3.793 15.710 1.00 -0.03 C HETATM 2010 CAQ UNN A 173 -37.224 3.168 15.468 1.00 -0.04 C HETATM 2011 CAS UNN A 173 -37.550 1.909 15.974 1.00 0.12 C HETATM 2012 FAT UNN A 173 -38.968 1.253 15.715 1.00 -0.19 F HETATM 2013 CAR UNN A 173 -36.597 1.238 16.719 1.00 -0.04 C HETATM 2014 CAP UNN A 173 -35.369 1.850 16.941 1.00 -0.03 C HETATM 2015 CAN UNN A 173 -35.013 3.099 16.406 1.00 0.09 C HETATM 2016 OAM UNN A 173 -33.775 3.683 16.653 1.00 -0.30 O HETATM 2017 CAL UNN A 173 -32.811 2.844 17.373 1.00 0.14 C HETATM 2018 CAJ UNN A 173 -32.501 1.695 16.357 1.00 0.15 C HETATM 2019 OAK UNN A 173 -32.744 1.906 15.164 1.00 -0.39 O HETATM 2020 CAC UNN A 173 -31.816 0.520 16.736 1.00 0.04 C HETATM 2021 CAB UNN A 173 -31.041 0.389 17.900 1.00 -0.07 C HETATM 2022 CAA UNN A 173 -30.344 -0.801 18.176 1.00 -0.05 C HETATM 2023 CAF UNN A 173 -30.413 -1.873 17.251 1.00 0.11 C HETATM 2024 OAI UNN A 173 -29.771 -3.080 17.379 1.00 -0.34 O HETATM 2025 H9 UNN A 173 -29.976 -3.628 16.630 1.00 0.25 H HETATM 2026 CAE UNN A 173 -31.127 -1.728 16.080 1.00 0.15 C HETATM 2027 OAH UNN A 173 -31.168 -2.769 15.210 1.00 -0.34 O HETATM 2028 H10 UNN A 173 -31.691 -2.528 14.454 1.00 0.24 H HETATM 2029 CAD UNN A 173 -31.782 -0.532 15.807 1.00 0.13 C HETATM 2030 OAG UNN A 173 -32.536 -0.442 14.681 1.00 -0.33 O HETATM 2031 H11 UNN A 173 -32.919 0.425 14.627 1.00 0.25 H HETATM 2032 H8 UNN A 173 -29.761 -0.897 19.085 1.00 0.04 H HETATM 2033 H7 UNN A 173 -30.979 1.218 18.596 1.00 0.05 H HETATM 2034 H5 UNN A 173 -33.251 2.443 18.298 1.00 0.08 H HETATM 2035 H6 UNN A 173 -31.900 3.411 17.616 1.00 0.08 H HETATM 2036 H4 UNN A 173 -34.645 1.334 17.562 1.00 0.05 H HETATM 2037 H3 UNN A 173 -36.804 0.253 17.122 1.00 0.06 H HETATM 2038 H2 UNN A 173 -37.956 3.685 14.859 1.00 0.06 H HETATM 2039 H1 UNN A 173 -35.817 4.803 15.361 1.00 0.05 H CONECT 1 2 5 6 7 CONECT 5 1 CONECT 6 1 CONECT 7 1 CONECT 436 434 435 1837 CONECT 626 625 1838 CONECT 894 893 1838 CONECT 895 893 1837 CONECT 1023 1021 1837 CONECT 1028 1027 1837 CONECT 1837 436 895 1023 1028 CONECT 1838 626 894 CONECT 2009 2010 2015 2039 CONECT 2010 2009 2011 2038 CONECT 2011 2010 2012 2013 CONECT 2012 2011 CONECT 2013 2011 2014 2037 CONECT 2014 2013 2015 2036 CONECT 2015 2009 2014 2016 CONECT 2016 2015 2017 CONECT 2017 2016 2018 2034 2035 CONECT 2018 2017 2019 2020 CONECT 2019 2018 CONECT 2020 2018 2021 2029 CONECT 2021 2020 2022 2033 CONECT 2022 2021 2023 2032 CONECT 2023 2022 2024 2026 CONECT 2024 2023 2025 CONECT 2025 2024 CONECT 2026 2023 2027 2029 CONECT 2027 2026 2028 CONECT 2028 2027 CONECT 2029 2020 2026 2030 CONECT 2030 2029 2031 CONECT 2031 2030 CONECT 2032 2022 CONECT 2033 2021 CONECT 2034 2017 CONECT 2035 2017 CONECT 2036 2014 CONECT 2037 2013 CONECT 2038 2010 CONECT 2039 2009 MASTER 0 0 0 0 0 0 0 0 2038 1 43 14 END
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Structure:
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Related entries of code: 4yyl
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
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RCSB PDB
PDBbind
183aa, >4AWK_1|Chain... at 95%
5fdd
RCSB PDB
PDBbind
191aa, >5FDD_1|Chain... at 93%
5fdg
RCSB PDB
PDBbind
191aa, >5FDG_1|Chain... at 93%
5i13
RCSB PDB
PDBbind
191aa, >5I13_1|Chain... at 93%
5w3i
RCSB PDB
PDBbind
201aa, >5W3I_1|Chain... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4yyl
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
influenza strain H1N1 polymerase subunit PA endonuclease
Ligand Name
4KN
EC.Number
E.C.-.-.-.-
Resolution
1.91(Å)
Affinity (Kd/Ki/IC50)
IC50=9.7uM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Bioorg.Med.Chem. Vol. 23: pp. 5466-5475
Ligand Properties
Formula
C
1
4
H
1
1
FO
5
Molecular Weight
278.233
Exact Mass
278.059
No. of atoms
31
No. of bonds
32
Polar Surface Area
86.99
LOGP Value
2.89 (
Computed with XLOGP3
)
2.20 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 2
Canonical SMILES
Fc1ccc(cc1)OCC(=O)c1ccc(c(c1O)O)O
InChI String
InChI=1S/C14H11FO5/c15-8-1-3-9(4-2-8)20-7-12(17)10-5-6-11(16)14(19)13(10)18/h1-6,16,18-19H,7H2
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P03433
Entrez Gene ID
NCBI Entrez Gene ID:
956535
ASD
Information of known allosteric effects of PDB entries
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